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937598-04-4 | N-(5-ACETYL-4-METHYL-1,3-THIAZOL-2-YL)-N-CYCLOPROPYL-4-METHYLBENZAMIDE
CAS No: 937598-04-4 Catalog No: AG01AO67 MDL No:MFCD08554858
Product Description
Catalog Number:
AG01AO67
Chemical Name:
N-(5-ACETYL-4-METHYL-1,3-THIAZOL-2-YL)-N-CYCLOPROPYL-4-METHYLBENZAMIDE
CAS Number:
937598-04-4
Molecular Formula:
C17H18N2O2S
Molecular Weight:
314.4020
MDL Number:
MFCD08554858
IUPAC Name:
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-N-cyclopropyl-4-methylbenzamide
InChI:
InChI=1S/C17H18N2O2S/c1-10-4-6-13(7-5-10)16(21)19(14-8-9-14)17-18-11(2)15(22-17)12(3)20/h4-7,14H,8-9H2,1-3H3
InChI Key:
YWANDSBHPPQIER-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)N(c1nc(c(s1)C(=O)C)C)C1CC1
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.109g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.403g/mol
Monoisotopic Mass:
314.109g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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