N-[1-(4-acetylanilino)-1-oxopropan-2-yl]-1-propyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[1-(4-acetylanilino)-1-oxopropan-2-yl]-1-propyl-1H-benzotriazole-5-carboxamide
N-[1-(4-acetylanilino)-1-oxopropan-2-yl]-1-propyl-1H-benzotriazole-5-carboxamide
Compound characteristics
Compound ID: | G851-0715 |
Compound Name: | N-[1-(4-acetylanilino)-1-oxopropan-2-yl]-1-propyl-1H-benzotriazole-5-carboxamide |
Molecular Weight: | 393.44 |
Molecular Formula: | C21 H23 N5 O3 |
Smiles: | CCCn1c2ccc(cc2nn1)C(NC(C)C(Nc1ccc(cc1)C(C)=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.9574 |
logD: | 1.9572 |
logSw: | -2.5702 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.68 |
InChI Key: | ZTSFFIQVHNWVGZ-ZDUSSCGKSA-N |