4-(4-tert-butylbenzene-1-sulfonyl)-1-(3-chlorophenyl)-1H-1,2,3-triazol-5-amine
Chemical Structure Depiction of
4-(4-tert-butylbenzene-1-sulfonyl)-1-(3-chlorophenyl)-1H-1,2,3-triazol-5-amine
4-(4-tert-butylbenzene-1-sulfonyl)-1-(3-chlorophenyl)-1H-1,2,3-triazol-5-amine
Compound characteristics
Compound ID: | C200-9399 |
Compound Name: | 4-(4-tert-butylbenzene-1-sulfonyl)-1-(3-chlorophenyl)-1H-1,2,3-triazol-5-amine |
Molecular Weight: | 390.89 |
Molecular Formula: | C18 H19 Cl N4 O2 S |
Smiles: | CC(C)(C)c1ccc(cc1)S(c1c(N)n(c2cccc(c2)[Cl])nn1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6126 |
logD: | 4.6126 |
logSw: | -4.6748 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.608 |
InChI Key: | LSEULLCOLQPIJA-UHFFFAOYSA-N |