N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0021 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 403.82 |
| Molecular Formula: | C19 H18 Cl N3 O5 |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NC(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8081 |
| logD: | 2.7997 |
| logSw: | -3.6871 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.081 |
| InChI Key: | ACEUSUHSIARUTO-UHFFFAOYSA-N |