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13253-59-3 | 2-Thiazolamine, 4-(6-chloro-1H-benzimidazol-2-yl)-
CAS No: 13253-59-3 Catalog No: AG0010SZ MDL No:
Product Description
Catalog Number:
AG0010SZ
Chemical Name:
2-Thiazolamine, 4-(6-chloro-1H-benzimidazol-2-yl)-
CAS Number:
13253-59-3
Molecular Formula:
C10H7ClN4S
Molecular Weight:
250.7074
IUPAC Name:
4-(6-chloro-1H-benzimidazol-2-yl)-1,3-thiazol-2-amine
InChI:
InChI=1S/C10H7ClN4S/c11-5-1-2-6-7(3-5)14-9(13-6)8-4-16-10(12)15-8/h1-4H,(H2,12,15)(H,13,14)
InChI Key:
CRWCWQYNGRIUFL-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)[nH]c(n2)c1csc(n1)N
NSC Number:
90510
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.008g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.704g/mol
Monoisotopic Mass:
250.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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