N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0088 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 417.85 |
| Molecular Formula: | C20 H20 Cl N3 O5 |
| Smiles: | CCNC1=C(C(=O)Oc2ccccc12)NC(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1706 |
| logD: | 3.1624 |
| logSw: | -3.7634 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.556 |
| InChI Key: | MDSAVXFVGSWDCM-UHFFFAOYSA-N |