N-(6-methyl-1,3-benzothiazol-2-yl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide
Chemical Structure Depiction of
N-(6-methyl-1,3-benzothiazol-2-yl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide
N-(6-methyl-1,3-benzothiazol-2-yl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide
Compound characteristics
| Compound ID: | C224-5030 |
| Compound Name: | N-(6-methyl-1,3-benzothiazol-2-yl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C22 H19 N3 O4 S3 |
| Smiles: | Cc1ccc2c(c1)sc(NC(c1ccc(cc1)NC(CCS(c1cccs1)(=O)=O)=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.0946 |
| logD: | 4.0928 |
| logSw: | -4.1743 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.023 |
| InChI Key: | LKSDCPFIYQQEHM-UHFFFAOYSA-N |