4-({[4-amino-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-2(1H)-one
Chemical Structure Depiction of
4-({[4-amino-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-2(1H)-one
4-({[4-amino-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-2(1H)-one
Compound characteristics
| Compound ID: | 8014-8952 |
| Compound Name: | 4-({[4-amino-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-2(1H)-one |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C19 H17 N5 O2 S |
| Smiles: | C(c1nnc(n1N)SCC1=CC(Nc2ccccc12)=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.2206 |
| logD: | 2.2205 |
| logSw: | -3.1141 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.436 |
| InChI Key: | OWQGYUUOWNNYSN-UHFFFAOYSA-N |