N-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
N-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide
Compound characteristics
Compound ID: | G851-0921 |
Compound Name: | N-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-N-methyl-1-(propan-2-yl)-1H-benzotriazole-5-carboxamide |
Molecular Weight: | 399.88 |
Molecular Formula: | C20 H22 Cl N5 O2 |
Smiles: | CC(C)n1c2ccc(cc2nn1)C(N(C)CC(Nc1ccc(cc1C)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0113 |
logD: | 3.0111 |
logSw: | -3.4495 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.006 |
InChI Key: | XWKNQKWEROILAU-UHFFFAOYSA-N |