1-(3-acetylphenyl)-4-{[amino(naphthalen-1-yl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
1-(3-acetylphenyl)-4-{[amino(naphthalen-1-yl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
1-(3-acetylphenyl)-4-{[amino(naphthalen-1-yl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-1201 |
| Compound Name: | 1-(3-acetylphenyl)-4-{[amino(naphthalen-1-yl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C26 H23 N3 O2 S |
| Smiles: | [H]C(c1cccc2ccccc12)(N)SC1C2CCCC=2N(C(N=1)=O)c1cccc(c1)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2615 |
| logD: | 3.2052 |
| logSw: | -3.6322 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.09 |
| InChI Key: | VLZFZRPYJPLUDK-DEOSSOPVSA-N |