N~4~-benzyl-5-nitropyrimidine-4,6-diamine
Chemical Structure Depiction of
N~4~-benzyl-5-nitropyrimidine-4,6-diamine
N~4~-benzyl-5-nitropyrimidine-4,6-diamine
Compound characteristics
Compound ID: | 8006-0712 |
Compound Name: | N~4~-benzyl-5-nitropyrimidine-4,6-diamine |
Molecular Weight: | 245.24 |
Molecular Formula: | C11 H11 N5 O2 |
Smiles: | C(c1ccccc1)Nc1c(c(N)ncn1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 1.5999 |
logD: | 1.5999 |
logSw: | -1.8357 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 84.399 |
InChI Key: | XWJNZVRWZJENTG-UHFFFAOYSA-N |