4-{[1-(butane-1-sulfonyl)piperidin-3-yl]oxy}-2-cyclopropyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Chemical Structure Depiction of
4-{[1-(butane-1-sulfonyl)piperidin-3-yl]oxy}-2-cyclopropyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
4-{[1-(butane-1-sulfonyl)piperidin-3-yl]oxy}-2-cyclopropyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | S897-0436 |
| Compound Name: | 4-{[1-(butane-1-sulfonyl)piperidin-3-yl]oxy}-2-cyclopropyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidine |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C20 H31 N3 O4 S |
| Smiles: | CCCCS(N1CCCC(C1)Oc1c2CCOCCc2nc(C2CC2)n1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0252 |
| logD: | 3.0252 |
| logSw: | -3.1003 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.552 |
| InChI Key: | QMXZZHNRNOOOPY-INIZCTEOSA-N |