N-(3-methylphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea
Chemical Structure Depiction of
N-(3-methylphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea
N-(3-methylphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea
Compound characteristics
| Compound ID: | D264-0866 |
| Compound Name: | N-(3-methylphenyl)-N'-[1-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butan-2-yl]urea |
| Molecular Weight: | 351.41 |
| Molecular Formula: | C19 H21 N5 O2 |
| Smiles: | CCC(CN1C(c2ccccc2N=N1)=O)NC(Nc1cccc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7611 |
| logD: | 3.7611 |
| logSw: | -3.9723 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.738 |
| InChI Key: | FRWPKRPQVQORBS-AWEZNQCLSA-N |