N-[3-(1H-imidazol-1-yl)propyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine
Chemical Structure Depiction of
N-[3-(1H-imidazol-1-yl)propyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine
N-[3-(1H-imidazol-1-yl)propyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine
Compound characteristics
Compound ID: | C848-0464 |
Compound Name: | N-[3-(1H-imidazol-1-yl)propyl]-4-(4-methylbenzene-1-sulfonyl)-2-(propane-1-sulfonyl)-1,3-thiazol-5-amine |
Molecular Weight: | 468.61 |
Molecular Formula: | C19 H24 N4 O4 S3 |
Smiles: | CCCS(c1nc(c(NCCCn2ccnc2)s1)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.819 |
logD: | 2.5771 |
logSw: | -3.2602 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 90.754 |
InChI Key: | NWXSVRPTZOBOEH-UHFFFAOYSA-N |