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99822-88-5 | N-(1-METHYL-2-(PIPERIDIN-1-YL)ETHYL)-2-(METHYLTHIO)-4-PHENYL-5-THIAZOLECARBOXAMIDE
CAS No: 99822-88-5 Catalog No: AG003W7M MDL No:
Product Description
Catalog Number:
AG003W7M
Chemical Name:
N-(1-METHYL-2-(PIPERIDIN-1-YL)ETHYL)-2-(METHYLTHIO)-4-PHENYL-5-THIAZOLECARBOXAMIDE
CAS Number:
99822-88-5
Molecular Formula:
C19H25N3OS2
Molecular Weight:
375.5513
IUPAC Name:
2-methylsulfanyl-4-phenyl-N-(1-piperidin-1-ylpropan-2-yl)-1,3-thiazole-5-carboxamide
InChI:
InChI=1S/C19H25N3OS2/c1-14(13-22-11-7-4-8-12-22)20-18(23)17-16(21-19(24-2)25-17)15-9-5-3-6-10-15/h3,5-6,9-10,14H,4,7-8,11-13H2,1-2H3,(H,20,23)
InChI Key:
SUIHBZSLWAQZGJ-UHFFFAOYSA-N
SMILES:
CSc1sc(c(n1)c1ccccc1)C(=O)NC(CN1CCCCC1)C
NSC Number:
610534
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.144g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
375.549g/mol
Monoisotopic Mass:
375.144g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
98.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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