N-[(2-chlorophenyl)methyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine
N-[(2-chlorophenyl)methyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine
Compound characteristics
| Compound ID: | C848-0467 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine |
| Molecular Weight: | 485.04 |
| Molecular Formula: | C20 H21 Cl N2 O4 S3 |
| Smiles: | CCCS(c1nc(c(NCc2ccccc2[Cl])s1)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1224 |
| logD: | 5.1224 |
| logSw: | -5.616 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.112 |
| InChI Key: | ITCXMYFADNGPFK-UHFFFAOYSA-N |