N-{4-[(3-methylbutyl)carbamoyl]phenyl}-1,2-benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-{4-[(3-methylbutyl)carbamoyl]phenyl}-1,2-benzothiazole-3-carboxamide
N-{4-[(3-methylbutyl)carbamoyl]phenyl}-1,2-benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | G795-0018 |
| Compound Name: | N-{4-[(3-methylbutyl)carbamoyl]phenyl}-1,2-benzothiazole-3-carboxamide |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C20 H21 N3 O2 S |
| Smiles: | CC(C)CCNC(c1ccc(cc1)NC(c1c2ccccc2sn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2461 |
| logD: | 4.246 |
| logSw: | -4.1236 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.846 |
| InChI Key: | FJDGGXRCCOWQJA-UHFFFAOYSA-N |