1,3-bis[(4-methoxyphenyl)methyl]-2-{4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}-1,3-diazinane
Chemical Structure Depiction of
1,3-bis[(4-methoxyphenyl)methyl]-2-{4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}-1,3-diazinane
1,3-bis[(4-methoxyphenyl)methyl]-2-{4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}-1,3-diazinane
Compound characteristics
| Compound ID: | 8013-8519 |
| Compound Name: | 1,3-bis[(4-methoxyphenyl)methyl]-2-{4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}-1,3-diazinane |
| Molecular Weight: | 607.63 |
| Molecular Formula: | C33 H32 F3 N3 O5 |
| Smiles: | COc1ccc(CN2CCCN(Cc3ccc(cc3)OC)C2c2ccc(cc2)Oc2ccc(cc2[N+]([O-])=O)C(F)(F)F)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.8572 |
| logD: | 6.8137 |
| logSw: | -5.8742 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.715 |
| InChI Key: | DHAWIWDWAMRVLR-UHFFFAOYSA-N |