N-(4-methoxyphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea
Chemical Structure Depiction of
N-(4-methoxyphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea
N-(4-methoxyphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea
Compound characteristics
| Compound ID: | V014-5023 |
| Compound Name: | N-(4-methoxyphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C23 H23 N5 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)Oc1nc(c2cccs2)n(c2cccc(c2)NC(Nc2ccc(cc2)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0476 |
| logD: | 6.0475 |
| logSw: | -5.5064 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.358 |
| InChI Key: | NBRDIVPQLKWECA-UHFFFAOYSA-N |