N-(5-chloro-2-methoxyphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea
N-(5-chloro-2-methoxyphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea
Compound characteristics
| Compound ID: | D264-0862 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea |
| Molecular Weight: | 401.85 |
| Molecular Formula: | C19 H20 Cl N5 O3 |
| Smiles: | CCC(CN1C(c2ccccc2N=N1)=O)NC(Nc1cc(ccc1OC)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.655 |
| logD: | 3.6548 |
| logSw: | -4.0417 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.671 |
| InChI Key: | RAWWLBZQWVFAOM-ZDUSSCGKSA-N |