4-(3-chlorophenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine
Chemical Structure Depiction of
4-(3-chlorophenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine
4-(3-chlorophenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine
Compound characteristics
| Compound ID: | V004-6358 |
| Compound Name: | 4-(3-chlorophenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine |
| Molecular Weight: | 387.84 |
| Molecular Formula: | C18 H14 Cl N3 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)[N+]([O-])=O)Oc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3637 |
| logD: | 5.3637 |
| logSw: | -5.9138 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.096 |
| InChI Key: | SJBRGVJQNKXJOS-UHFFFAOYSA-N |