N-({1-[(4-chlorophenyl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-({1-[(4-chlorophenyl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide
N-({1-[(4-chlorophenyl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | SD07-0944 |
| Compound Name: | N-({1-[(4-chlorophenyl)methyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)-1-ethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 455.95 |
| Molecular Formula: | C22 H26 Cl N7 O2 |
| Smiles: | CCn1c(ccn1)C(NCc1c2COC3(CCN(Cc4ccc(cc4)[Cl])C3)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6017 |
| logD: | 1.3328 |
| logSw: | -2.7275 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.617 |
| InChI Key: | KDXYPKUKCJGTDL-QFIPXVFZSA-N |