N-({1-[(4-chlorophenyl)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-2-methylpropanamide
Chemical Structure Depiction of
N-({1-[(4-chlorophenyl)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-2-methylpropanamide
N-({1-[(4-chlorophenyl)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-2-methylpropanamide
Compound characteristics
| Compound ID: | SD07-0171 |
| Compound Name: | N-({1-[(4-chlorophenyl)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-2-methylpropanamide |
| Molecular Weight: | 431.92 |
| Molecular Formula: | C21 H26 Cl N5 O3 |
| Smiles: | CC(C)C(NCc1c2COC3(CCN(C3)C(Cc3ccc(cc3)[Cl])=O)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6674 |
| logD: | 1.6674 |
| logSw: | -2.7168 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.188 |
| InChI Key: | AEUQNQSAIGGUIH-NRFANRHFSA-N |