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CAS 391901-45-4 manufacturers and suppliers on PharmaCompass

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2-((4-Aminophenethyl)Amino)-1-Phenylethanol, (R)-
Also known as: 391901-45-4, Mirabegron (m16), Ym-208876, 2-((4-aminophenethyl)amino)-1-phenylethanol, (r)-, 16j30iow0v, (1r)-2-[2-(4-aminophenyl)ethylamino]-1-phenylethanol
Molecular Formula
C16H20N2O
Molecular Weight
256.34  g/mol
InChI Key
TUAHDMSPHZSMQN-INIZCTEOSA-N
FDA UNII
16J30IOW0V

1 2D Structure

2-((4-Aminophenethyl)Amino)-1-Phenylethanol, (R)-

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1R)-2-[2-(4-aminophenyl)ethylamino]-1-phenylethanol
2.1.2 InChI
InChI=1S/C16H20N2O/c17-15-8-6-13(7-9-15)10-11-18-12-16(19)14-4-2-1-3-5-14/h1-9,16,18-19H,10-12,17H2/t16-/m0/s1
2.1.3 InChI Key
TUAHDMSPHZSMQN-INIZCTEOSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C(CNCCC2=CC=C(C=C2)N)O
2.1.5 Isomeric SMILES
C1=CC=C(C=C1)[C@H](CNCCC2=CC=C(C=C2)N)O
2.2 Other Identifiers
2.2.1 UNII
16J30IOW0V
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 391901-45-4

2. Mirabegron (m16)

3. Ym-208876

4. 2-((4-aminophenethyl)amino)-1-phenylethanol, (r)-

5. 16j30iow0v

6. (1r)-2-[2-(4-aminophenyl)ethylamino]-1-phenylethanol

7. Unii-16j30iow0v

8. (r)-2-(4-aminophenethylamino)-1-phenylethanol

9. Schembl7118929

10. Chembl3550279

11. Benzenemethanol, A-[[[2-(4-aminophenyl)ethyl]amino]methyl]-, (ar)-

12. Mfcd28125625

13. Zinc98181740

14. Akos024464547

15. Benzenemethanol, Alpha-(((2-(4-aminophenyl)ethyl)amino)methyl)-, (alphar)-

16. Ds-7233

17. Cs-0156602

18. (1r)-2-(4-aminophenethylamino)-1-phenylethanol

19. A873697

20. Q27251817

21. Benzenemethanol, .alpha.-(((2-(4-aminophenyl)ethyl)amino)methyl)-, (.alpha.r)-

2.4 Create Date
2011-06-20
3 Chemical and Physical Properties
Molecular Weight 256.34 g/mol
Molecular Formula C16H20N2O
XLogP31.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass256.157563266 g/mol
Monoisotopic Mass256.157563266 g/mol
Topological Polar Surface Area58.3 Ų
Heavy Atom Count19
Formal Charge0
Complexity233
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Digital Content Digital Content
URL Supplier Web Content
521284-22-0
Mirabegron
Mehta API Pvt Ltd engaged in manufacturing and marketing of APIs & Advance Drug Intermediates.... Globall...
Mehta API Pvt Ltd engaged in manufacturing and marketing of APIs & Advance Drug Intermediates.... Globally. Mehta Api has been inordinately proud of its achievements since its inception .Our journey is paved with many success stories. Much of it has, in many ways, been unprecedented in the Pharma industry. Our success has been validated by what we hold the dearest - Product Excellence and Customer service. We believe that long-term business success is rooted in value. Business ethics are good business; they are like a long-term insurance policy. We are committed to Excellence in Product Quality and adherence to stringent delivery schedule.
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