N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0161 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 431.87 |
| Molecular Formula: | C21 H22 Cl N3 O5 |
| Smiles: | CCCNC1=C(C(=O)Oc2ccccc12)NC(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6119 |
| logD: | 3.6038 |
| logSw: | -4.0506 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.772 |
| InChI Key: | JULJUDHZODYJEV-UHFFFAOYSA-N |