5-bromo-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]pyridine-3-carboxamide
Chemical Structure Depiction of
5-bromo-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]pyridine-3-carboxamide
5-bromo-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4194-0100 |
| Compound Name: | 5-bromo-N-[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)carbamothioyl]pyridine-3-carboxamide |
| Molecular Weight: | 392.23 |
| Molecular Formula: | C14 H10 Br N5 O2 S |
| Smiles: | c1cc2c(cc1NC(NC(c1cc(cnc1)[Br])=O)=S)NC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4765 |
| logD: | 2.4598 |
| logSw: | -2.8405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 78.574 |
| InChI Key: | LTCMUQSTKOYCDB-UHFFFAOYSA-N |