3-{3-[4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{3-[4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one
3-{3-[4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SC69-0731 |
| Compound Name: | 3-{3-[4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C23 H27 N5 O3 |
| Smiles: | C1CCC2(C1)CN(CC2c1nncn1C1CC1)C(CCN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8976 |
| logD: | 1.8975 |
| logSw: | -2.3062 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.665 |
| InChI Key: | YRLVULBZTSSREH-KRWDZBQOSA-N |