Amlodipine Mesylate

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Also known as: 246852-12-0, 3-ethyl 5-methyl 2-((2-aminoethoxy)methyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate methanesulfonate, Amlodipine mesilate, 291y33ezha, 246852-12-0 (mesylate), 3,5-pyridinedicarboxylic acid, 2-((2-aminoethoxy)methyl)-4-(2-chlorophenyl)-1,4-dihydro-6-methyl-, 3-ethyl 5-methyl ester methanesulfonate (1:1)

Molecular Formula

C₂₁H₂₉ClN₂O₈S

Molecular Weight

505.0 g/mol

InChI Key

MUVFCHUBATVFPP-UHFFFAOYSA-N

FDA UNII

291Y33EZHA

1 2D Structure

Amlodipine Mesylate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-O-ethyl 5-O-methyl 2-(2-aminoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate;methanesulfonic acid

2.1.2 InChI

InChI=1S/C20H25ClN2O5.CH4O3S/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;1-5(2,3)4/h5-8,17,23H,4,9-11,22H2,1-3H3;1H3,(H,2,3,4)

2.1.3 InChI Key

MUVFCHUBATVFPP-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCN.CS(=O)(=O)O

2.2 Other Identifiers

2.2.1 UNII

291Y33EZHA

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 246852-12-0

2. 3-ethyl 5-methyl 2-((2-aminoethoxy)methyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Methanesulfonate

3. Amlodipine Mesilate

4. 291y33ezha

5. 246852-12-0 (mesylate)

6. 3,5-pyridinedicarboxylic Acid, 2-((2-aminoethoxy)methyl)-4-(2-chlorophenyl)-1,4-dihydro-6-methyl-, 3-ethyl 5-methyl Ester Methanesulfonate (1:1)

7. 3-o-ethyl 5-o-methyl 2-(2-aminoethoxymethyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate;methanesulfonic Acid

8. 3-ethyl 5-methyl 2-[(2-aminoethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate; Methanesulfonic Acid

9. Unii-291y33ezha

10. Amlodipine (mesylate)

11. Schembl1164621

12. Amlodipine (as Mesilate)

13. Hy-b0317c

14. Amy7135

15. Bcp11874

16. Wja85212

17. Amlodipine Mesilate [who-dd]

18. As-75125

19. D93316

20. Q27254365

21. 3-ethyl5-methyl2-((2-aminoethoxy)methyl)-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylatemethanesulfonate

2.3.2 Other Synonyms

1. Amilostad

2. Amlodipine Mesylate Monohydrate

3. Amlodipine Mesilate Monohydrate

4. Cardilopina

2.4 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₂₁H₂₉ClN₂O₈S
Molecular Weight	505.0 g/mol
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	10
Exact Mass	504.1333148 g/mol
Monoisotopic Mass	504.1333148 g/mol
Topological Polar Surface Area	163 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	739
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2