CC1=C(SC(=N1)Br)C(=O)NCC2=CN=CC=C2
CAS: 1009378-44-2
Name: 2-bromo-4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide
SMILES: CC1=C(SC(=N1)Br)C(=O)NCC2=CN=CC=C2

Molecular Processing

Molecular formula
C11H10BrN3OS
Molecular weight
312.19
Exact mass
310.9728
XLogP
2.54
TPSA
54.88
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
69.96

Supplementary Information

InChIKey: METLDSYYZSNANU-UHFFFAOYSA-N
Synonyme
1009378-44-22-Bromo-4-methyl-N-(pyridin-3-ylmethyl)thiazole-5-carboxamide5-Thiazolecarboxamide, 2-bromo-4-methyl-N-(3-pyridinylmethyl)-SCHEMBL245193METLDSYYZSNANU-UHFFFAOYSA-NBHA050482-bromo-4-methyl-thiazole-5-carboxylic acid (pyridine-3-ylmethyl)-amideDB-364800
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