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Home > Thiazole > 1422061-25-3
1422061-25-3 | N-(3-chlorophenyl)-5,6,7,8-tetrahydro-4H-thiazolo[4,5-d]azepine-2-carboxamide
CAS No: 1422061-25-3 Catalog No: AG01DJKY MDL No:
Product Description
Catalog Number:
AG01DJKY
Chemical Name:
N-(3-chlorophenyl)-5,6,7,8-tetrahydro-4H-thiazolo[4,5-d]azepine-2-carboxamide
CAS Number:
1422061-25-3
Molecular Formula:
C14H14ClN3OS
Molecular Weight:
307.7985
IUPAC Name:
N-(3-chlorophenyl)-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepine-2-carboxamide
InChI:
InChI=1S/C14H14ClN3OS/c15-9-2-1-3-10(8-9)17-13(19)14-18-11-4-6-16-7-5-12(11)20-14/h1-3,8,16H,4-7H2,(H,17,19)
InChI Key:
UGGYGMAMUXIQLX-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)NC(=O)c1nc2c(s1)CCNCC2
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.055g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
307.796g/mol
Monoisotopic Mass:
307.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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