N-butyl-2-(ethanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine
Chemical Structure Depiction of
N-butyl-2-(ethanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine
N-butyl-2-(ethanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine
Compound characteristics
| Compound ID: | C848-0243 |
| Compound Name: | N-butyl-2-(ethanesulfonyl)-4-(4-methylbenzene-1-sulfonyl)-1,3-thiazol-5-amine |
| Molecular Weight: | 402.55 |
| Molecular Formula: | C16 H22 N2 O4 S3 |
| Smiles: | CCCCNc1c(nc(s1)S(CC)(=O)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9292 |
| logD: | 3.9292 |
| logSw: | -3.8076 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.225 |
| InChI Key: | NROZRQWRKDNOAI-UHFFFAOYSA-N |