N-(2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
N-(2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | 8010-3655 |
| Compound Name: | N-(2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide |
| Molecular Weight: | 605.76 |
| Molecular Formula: | C28 H27 N7 O3 S3 |
| Smiles: | CCC(C(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccc(cc1)OCC)=O)=O)Sc1nnnn1c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2105 |
| logD: | 6.2105 |
| logSw: | -5.4278 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.335 |
| InChI Key: | QWVDYCSFYZSUDP-QHCPKHFHSA-N |