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Home > Thiazole > 1422066-64-5
1422066-64-5 | N-(2-methylpropyl)-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepine-2-carboxamide
CAS No: 1422066-64-5 Catalog No: AG01DHQW MDL No:
Product Description
Catalog Number:
AG01DHQW
Chemical Name:
N-(2-methylpropyl)-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepine-2-carboxamide
CAS Number:
1422066-64-5
Molecular Formula:
C12H19N3OS
Molecular Weight:
253.3638
IUPAC Name:
N-(2-methylpropyl)-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepine-2-carboxamide
InChI:
InChI=1S/C12H19N3OS/c1-8(2)7-14-11(16)12-15-9-3-5-13-6-4-10(9)17-12/h8,13H,3-7H2,1-2H3,(H,14,16)
InChI Key:
TUGFPTIEIKYHSY-UHFFFAOYSA-N
SMILES:
CC(CNC(=O)c1nc2c(s1)CCNCC2)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.125g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.364g/mol
Monoisotopic Mass:
253.125g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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