5-nitro-N~4~,N~6~-bis[(4-propoxyphenyl)methyl]pyrimidine-4,6-diamine
Chemical Structure Depiction of
5-nitro-N~4~,N~6~-bis[(4-propoxyphenyl)methyl]pyrimidine-4,6-diamine
5-nitro-N~4~,N~6~-bis[(4-propoxyphenyl)methyl]pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | 4298-0573 |
| Compound Name: | 5-nitro-N~4~,N~6~-bis[(4-propoxyphenyl)methyl]pyrimidine-4,6-diamine |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C24 H29 N5 O4 |
| Smiles: | CCCOc1ccc(CNc2c(c(NCc3ccc(cc3)OCCC)ncn2)[N+]([O-])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3021 |
| logD: | 5.3021 |
| logSw: | -5.4132 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.412 |
| InChI Key: | SHQCSMGFPVJSQC-UHFFFAOYSA-N |