rel-(4R,5R)-N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-(methanesulfonyl)-10-oxo-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
rel-(4R,5R)-N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-(methanesulfonyl)-10-oxo-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
rel-(4R,5R)-N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-(methanesulfonyl)-10-oxo-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | SC77-0700 |
| Compound Name: | rel-(4R,5R)-N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-(methanesulfonyl)-10-oxo-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C17 H31 N5 O5 S |
| Smiles: | CCN1CCN(CCNC([C@H]2CN(C[C@]23C(NCCO3)=O)S(C)(=O)=O)=O)CC1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.7717 |
| logD: | -2.5643 |
| logSw: | -1.5113 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.634 |
| InChI Key: | NSZPKOLBNMAFIK-PBHICJAKSA-N |