6-(butan-2-yl)-2-cyclohexyltetrahydro-5H-2,3,4a,6,7a-pentaazacyclopenta[cd]indene-1,4(2H,3H)-dione
Chemical Structure Depiction of
6-(butan-2-yl)-2-cyclohexyltetrahydro-5H-2,3,4a,6,7a-pentaazacyclopenta[cd]indene-1,4(2H,3H)-dione
6-(butan-2-yl)-2-cyclohexyltetrahydro-5H-2,3,4a,6,7a-pentaazacyclopenta[cd]indene-1,4(2H,3H)-dione
Compound characteristics
| Compound ID: | 8019-0088 |
| Compound Name: | 6-(butan-2-yl)-2-cyclohexyltetrahydro-5H-2,3,4a,6,7a-pentaazacyclopenta[cd]indene-1,4(2H,3H)-dione |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C16 H27 N5 O2 |
| Smiles: | CCC(C)N1CN2C3C(NC2=O)N(C2CCCCC2)C(N3C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9326 |
| logD: | 0.6297 |
| logSw: | -3.1372 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.521 |
| InChI Key: | PHSZPWDBBSPHRA-UHFFFAOYSA-N |