N-(2-{[(4-{[2-(benzylamino)-2-oxoethyl]sulfanyl}phenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide
Chemical Structure Depiction of
N-(2-{[(4-{[2-(benzylamino)-2-oxoethyl]sulfanyl}phenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide
N-(2-{[(4-{[2-(benzylamino)-2-oxoethyl]sulfanyl}phenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide
Compound characteristics
| Compound ID: | 8007-7671 |
| Compound Name: | N-(2-{[(4-{[2-(benzylamino)-2-oxoethyl]sulfanyl}phenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-(decyloxy)benzamide |
| Molecular Weight: | 712.01 |
| Molecular Formula: | C40 H45 N3 O3 S3 |
| Smiles: | CCCCCCCCCCOc1ccc(cc1)C(Nc1ccc2c(c1)sc(n2)SCc1ccc(cc1)SCC(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 10.9248 |
| logD: | 10.9245 |
| logSw: | -5.6202 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.757 |
| InChI Key: | CHUZIGDQZXOQCH-UHFFFAOYSA-N |