N-({1-[(3-methylphenoxy)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)propane-2-sulfonamide
Chemical Structure Depiction of
N-({1-[(3-methylphenoxy)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)propane-2-sulfonamide
N-({1-[(3-methylphenoxy)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)propane-2-sulfonamide
Compound characteristics
Compound ID: | SD07-0700 |
Compound Name: | N-({1-[(3-methylphenoxy)acetyl]-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl}methyl)propane-2-sulfonamide |
Molecular Weight: | 463.55 |
Molecular Formula: | C21 H29 N5 O5 S |
Smiles: | CC(C)S(NCc1c2COC3(CCN(C3)C(COc3cccc(C)c3)=O)Cn2nn1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.1256 |
logD: | 1.115 |
logSw: | -2.4181 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 100.032 |
InChI Key: | PHKRHFKWJSGGDW-NRFANRHFSA-N |