N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-N'-(3-bromophenyl)urea
Chemical Structure Depiction of
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-N'-(3-bromophenyl)urea
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-N'-(3-bromophenyl)urea
Compound characteristics
| Compound ID: | F996-0032 |
| Compound Name: | N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-N'-(3-bromophenyl)urea |
| Molecular Weight: | 438.28 |
| Molecular Formula: | C21 H16 Br N3 O3 |
| Smiles: | COc1ccc(cc1NC(Nc1cccc(c1)[Br])=O)c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 5.8185 |
| logD: | 5.8185 |
| logSw: | -5.6679 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.284 |
| InChI Key: | BTDDINPKSHBEMA-UHFFFAOYSA-N |