N~1~,N~1~-dimethyl-N~3~-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]propane-1,3-diamine
Chemical Structure Depiction of
N~1~,N~1~-dimethyl-N~3~-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]propane-1,3-diamine
N~1~,N~1~-dimethyl-N~3~-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]propane-1,3-diamine
Compound characteristics
| Compound ID: | C848-0453 |
| Compound Name: | N~1~,N~1~-dimethyl-N~3~-[4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-yl]propane-1,3-diamine |
| Molecular Weight: | 445.62 |
| Molecular Formula: | C18 H27 N3 O4 S3 |
| Smiles: | CCCS(c1nc(c(NCCCN(C)C)s1)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9135 |
| logD: | 0.9144 |
| logSw: | -3.3934 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.09 |
| InChI Key: | BLPYYVXNEAPCOP-UHFFFAOYSA-N |