4-chloro-N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide
4-chloro-N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3061-4584 |
| Compound Name: | 4-chloro-N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide |
| Molecular Weight: | 455.26 |
| Molecular Formula: | C21 H12 Cl2 N4 O4 |
| Smiles: | c1ccc2c(c1)C(N(C(c1cccc(c1)[Cl])=N2)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4539 |
| logD: | 2.4328 |
| logSw: | -4.1066 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.832 |
| InChI Key: | XVCSBWDFCYYKEQ-UHFFFAOYSA-N |