N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Compound characteristics
| Compound ID: | 8008-3023 |
| Compound Name: | N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C21 H23 N3 O3 S2 |
| Smiles: | CCCCNC(CSc1nc2ccc(cc2s1)NC(c1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2996 |
| logD: | 4.2883 |
| logSw: | -4.3304 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.354 |
| InChI Key: | WDZKKKOZNSARET-UHFFFAOYSA-N |