N-propyl-N'-{[1-(thiophene-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
Chemical Structure Depiction of
N-propyl-N'-{[1-(thiophene-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
N-propyl-N'-{[1-(thiophene-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea
Compound characteristics
| Compound ID: | SD07-0506 |
| Compound Name: | N-propyl-N'-{[1-(thiophene-3-carbonyl)-4'H,7'H-spiro[pyrrolidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}urea |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C18 H24 N6 O3 S |
| Smiles: | CCCNC(NCc1c2COC3(CCN(C3)C(c3ccsc3)=O)Cn2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3381 |
| logD: | 0.3381 |
| logSw: | -2.1191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.109 |
| InChI Key: | KHPSBTNMANWHNQ-SFHVURJKSA-N |