2-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
2-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-6329 |
| Compound Name: | 2-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 484.69 |
| Molecular Formula: | C27 H44 N6 O2 |
| Salt: | not_available |
| Smiles: | C1CCC(CC1)C(N1CCCN(CC1)C1NC(C=C(CN2CCN(CC2)C2CCCCC2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8583 |
| logD: | 1.4517 |
| logSw: | -3.0901 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.168 |
| InChI Key: | DQEBGTIQKRVWHD-UHFFFAOYSA-N |