N-(2-methoxy-4-nitrophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(2-methoxy-4-nitrophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
N-(2-methoxy-4-nitrophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0036 |
| Compound Name: | N-(2-methoxy-4-nitrophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 384.35 |
| Molecular Formula: | C18 H16 N4 O6 |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NC(Nc1ccc(cc1OC)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3248 |
| logD: | 2.309 |
| logSw: | -3.1339 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.832 |
| InChI Key: | UVHSZHOOVPMRGI-UHFFFAOYSA-N |