[rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl](thiophen-2-yl)methanone
[rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl](thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | S572-0217 |
| Compound Name: | [rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl](thiophen-2-yl)methanone |
| Molecular Weight: | 285.37 |
| Molecular Formula: | C15 H15 N3 O S |
| Smiles: | Cc1ncc2c(C[C@@H]3CC[C@H]2N3C(c2cccs2)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.759 |
| logD: | 1.759 |
| logSw: | -2.1827 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.536 |
| InChI Key: | NSVGOYONYTUEDQ-MFKMUULPSA-N |