6-chloro-3-{2-oxo-2-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-chloro-3-{2-oxo-2-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one
6-chloro-3-{2-oxo-2-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SD74-1029 |
| Compound Name: | 6-chloro-3-{2-oxo-2-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]ethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 429.91 |
| Molecular Formula: | C21 H24 Cl N5 O3 |
| Smiles: | CCCn1cnnc1C1CN(CC12CCC2)C(CN1C(=O)Oc2cc(ccc12)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.206 |
| logD: | 2.2059 |
| logSw: | -3.1622 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.279 |
| InChI Key: | WMYBMUPSDLEDTH-HNNXBMFYSA-N |