CAS 819871-13-1 manufacturers and suppliers on PharmaCompass

PharmaCompass

Chemistry

Click the arrow to open the dropdown
read-moreClick the button for full data set
Also known as: 819871-13-1, 6n7g3us2ah, C,c'-bis(1,1-dimethylethyl) n,n'-((1s)-1-((((1s)-1-methyl-2-phenylethyl)amino)carbonyl)-1,5-pentanediyl)bis(carbamate), Refchem:199899, Unii-6n7g3us2ah, N~2~,n~6~-bis(tert-butoxycarbonyl)-n-[(2s)-1-phenylpropan-2-yl]-l-lysinamide
Molecular Formula
C25H41N3O5
Molecular Weight
463.6  g/mol
InChI Key
GLKQQPKRLLPLBN-ICSRJNTNSA-N
FDA UNII
6N7G3US2AH

CAS 819871-13-1
1 2D Structure

CAS 819871-13-1

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
tert-butyl N-[(2S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxo-1-[[(2S)-1-phenylpropan-2-yl]amino]hexan-2-yl]carbamate
2.1.2 InChI
InChI=1S/C25H41N3O5/c1-18(17-19-13-9-8-10-14-19)27-21(29)20(28-23(31)33-25(5,6)7)15-11-12-16-26-22(30)32-24(2,3)4/h8-10,13-14,18,20H,11-12,15-17H2,1-7H3,(H,26,30)(H,27,29)(H,28,31)/t18-,20-/m0/s1
2.1.3 InChI Key
GLKQQPKRLLPLBN-ICSRJNTNSA-N
2.2 Other Identifiers
2.2.1 UNII
6N7G3US2AH
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 819871-13-1

2. 6n7g3us2ah

3. C,c'-bis(1,1-dimethylethyl) N,n'-((1s)-1-((((1s)-1-methyl-2-phenylethyl)amino)carbonyl)-1,5-pentanediyl)bis(carbamate)

4. Refchem:199899

5. Unii-6n7g3us2ah

6. N~2~,n~6~-bis(tert-butoxycarbonyl)-n-[(2s)-1-phenylpropan-2-yl]-l-lysinamide

7. Carbamic Acid, N,n'-((1s)-1-((((1s)-1-methyl-2-phenylethyl)amino)carbonyl)-1,5-pentanediyl)bis-, C,c'-bis(1,1-dimethylethyl) Ester

8. Tert-butyl N-[(2s)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxo-1-[[(2s)-1-phenylpropan-2-yl]amino]hexan-2-yl]carbamate

9. Di-tert-butyl ((s)-6-oxo-6-(((s)-1-phenylpropan-2-yl)amino)hexane-1,5-diyl)dicarbamate

10. Aspartame Impurity 4

11. Schembl10135741

12. Dtxsid00652361

13. Fb18749

14. [(1s)-1-[[[(1s)-1-methyl-2-phenylethyl]amino]carbonyl]-1,5-pentanediyl]bis-carbamic Acid Bis(1,1-dimethylethyl) Ester

15. Carbamic Acid, N,n'-[(1s)-1-[[[(1s)-1-methyl-2-phenylethyl]amino]carbonyl]-1,5-pentanediyl]bis-, C,c'-bis(1,1-dimethylethyl) Ester; Acid, [(1s)-1-[[[(1s)-1-methyl-2-phenylethyl]amino]carbonyl]-1,5-pentanediyl]bis-, Bis(1,1-dimethylethyl) Ester (9ci); N,n'-bis(tert-butoxycarbonyl)lisdexamfetamine

2.4 Create Date
2009-05-28
3 Chemical and Physical Properties
Molecular Weight 463.6 g/mol
Molecular Formula C25H41N3O5
XLogP34.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area106
Heavy Atom Count33
Formal Charge0
Complexity619
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

Upload your portfolio for free, ask us

END USE APIs

read-more
read-more
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty