N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea
Chemical Structure Depiction of
N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea
N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea
Compound characteristics
| Compound ID: | F129-0100 |
| Compound Name: | N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(4-methyl-2-nitrophenyl)urea |
| Molecular Weight: | 382.37 |
| Molecular Formula: | C19 H18 N4 O5 |
| Smiles: | CCNC1=C(C(=O)Oc2ccccc12)NC(Nc1ccc(C)cc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1603 |
| logD: | 3.113 |
| logSw: | -3.7164 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.376 |
| InChI Key: | XKEQQNZAXWVOCG-UHFFFAOYSA-N |