N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea
Chemical Structure Depiction of
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea
Compound characteristics
| Compound ID: | F129-0033 |
| Compound Name: | N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea |
| Molecular Weight: | 368.35 |
| Molecular Formula: | C18 H16 N4 O5 |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)NC(NC1=C(c2ccccc2OC1=O)NC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7978 |
| logD: | 2.7483 |
| logSw: | -3.6309 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.9 |
| InChI Key: | NEJFYPSJDZCANO-UHFFFAOYSA-N |