N-[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(5-chloro-2-methylphenyl)urea
Chemical Structure Depiction of
N-[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(5-chloro-2-methylphenyl)urea
N-[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(5-chloro-2-methylphenyl)urea
Compound characteristics
Compound ID: | F129-0451 |
Compound Name: | N-[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(5-chloro-2-methylphenyl)urea |
Molecular Weight: | 433.89 |
Molecular Formula: | C24 H20 Cl N3 O3 |
Smiles: | Cc1ccc(cc1NC(NC1=C(c2ccccc2OC1=O)NCc1ccccc1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.3729 |
logD: | 3.8978 |
logSw: | -4.7393 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 63.398 |
InChI Key: | OWWHZJPBTXHZEI-UHFFFAOYSA-N |