4-(4-chlorophenoxy)-6-{3-methyl-4-[(3-nitrophenyl)methyl]piperazin-1-yl}pyrimidine
Chemical Structure Depiction of
4-(4-chlorophenoxy)-6-{3-methyl-4-[(3-nitrophenyl)methyl]piperazin-1-yl}pyrimidine
4-(4-chlorophenoxy)-6-{3-methyl-4-[(3-nitrophenyl)methyl]piperazin-1-yl}pyrimidine
Compound characteristics
| Compound ID: | V027-9290 |
| Compound Name: | 4-(4-chlorophenoxy)-6-{3-methyl-4-[(3-nitrophenyl)methyl]piperazin-1-yl}pyrimidine |
| Molecular Weight: | 439.9 |
| Molecular Formula: | C22 H22 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1Cc1cccc(c1)[N+]([O-])=O)c1cc(ncn1)Oc1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5746 |
| logD: | 4.5088 |
| logSw: | -4.9027 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.919 |
| InChI Key: | CHPVUDJDWXNTIS-INIZCTEOSA-N |