N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea
N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0160 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 389.81 |
| Molecular Formula: | C19 H17 Cl F N3 O3 |
| Smiles: | CCCNC1=C(C(=O)Oc2ccccc12)NC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0423 |
| logD: | 4.0114 |
| logSw: | -4.55 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.209 |
| InChI Key: | DTUXRHUETHAURN-UHFFFAOYSA-N |