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874658-77-2 | Butanamide, N-(2-amino-4,5,6,7-tetrahydro-6-benzothiazolyl)-
CAS No: 874658-77-2 Catalog No: AG004I7M MDL No:
Product Description
Catalog Number:
AG004I7M
Chemical Name:
Butanamide, N-(2-amino-4,5,6,7-tetrahydro-6-benzothiazolyl)-
CAS Number:
874658-77-2
Molecular Formula:
C11H17N3OS
Molecular Weight:
239.3372
IUPAC Name:
N-(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)butanamide
InChI:
InChI=1S/C11H17N3OS/c1-2-3-10(15)13-7-4-5-8-9(6-7)16-11(12)14-8/h7H,2-6H2,1H3,(H2,12,14)(H,13,15)
InChI Key:
SKRDSDOYTKVADO-UHFFFAOYSA-N
SMILES:
CCCC(=O)NC1CCc2c(C1)sc(n2)N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.109g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.337g/mol
Monoisotopic Mass:
239.109g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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