N-(4-bromophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(4-bromophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
N-(4-bromophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0029 |
| Compound Name: | N-(4-bromophenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 388.22 |
| Molecular Formula: | C17 H14 Br N3 O3 |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3423 |
| logD: | 3.3352 |
| logSw: | -3.9418 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.518 |
| InChI Key: | ZLIKBFLAAWMQDD-UHFFFAOYSA-N |