N-(adamantan-2-yl)-3-nitro-4-(pyrrolidin-1-yl)benzamide
Chemical Structure Depiction of
N-(adamantan-2-yl)-3-nitro-4-(pyrrolidin-1-yl)benzamide
N-(adamantan-2-yl)-3-nitro-4-(pyrrolidin-1-yl)benzamide
Compound characteristics
| Compound ID: | 8016-4666 |
| Compound Name: | N-(adamantan-2-yl)-3-nitro-4-(pyrrolidin-1-yl)benzamide |
| Molecular Weight: | 369.46 |
| Molecular Formula: | C21 H27 N3 O3 |
| Smiles: | [H][C@@]12C[C@@]3([H])C[C@@]([H])(C1)C([C@@]([H])(C2)C3)NC(c1ccc(c(c1)[N+]([O-])=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3966 |
| logD: | 4.3966 |
| logSw: | -4.456 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.597 |
| InChI Key: | AQJNPPDYBZJQMO-UHFFFAOYSA-N |