5-chloro-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-chloro-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
5-chloro-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 2713-0108 |
| Compound Name: | 5-chloro-1,3-bis[(4-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 416.78 |
| Molecular Formula: | C18 H13 Cl N4 O6 |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)N1C=C(C(N(Cc2ccc(cc2)[N+]([O-])=O)C1=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1063 |
| logD: | 3.1063 |
| logSw: | -3.4095 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 99.16 |
| InChI Key: | AQMWDQFBXFOKHX-UHFFFAOYSA-N |