N-benzyl-2-{2-[4-(methanesulfonyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-2-{2-[4-(methanesulfonyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-2-{2-[4-(methanesulfonyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0553 |
| Compound Name: | N-benzyl-2-{2-[4-(methanesulfonyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 479.51 |
| Molecular Formula: | C23 H21 N5 O5 S |
| Smiles: | CS(c1ccc(cc1)NC(CN1C(N2C=C(C=CC2=N1)C(NCc1ccccc1)=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1251 |
| logD: | 1.1243 |
| logSw: | -2.3831 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.111 |
| InChI Key: | TZDBILZDZSOMPE-UHFFFAOYSA-N |