N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
Compound characteristics
| Compound ID: | L862-0243 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[5,7-dioxo-6-propyl-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C22 H31 N5 O3 S |
| Smiles: | CCCN1C(c2c(nc(N3CCCC3)s2)N(CC(NCCC2CCCCC=2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7607 |
| logD: | 3.7607 |
| logSw: | -3.6596 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.944 |
| InChI Key: | XWONTVYRTXGFRS-UHFFFAOYSA-N |