2-cyclopropyl-6-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]-6,7,8,9-tetrahydro-5H-pyrimido[5,4-c]azepin-5-one
Chemical Structure Depiction of
2-cyclopropyl-6-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]-6,7,8,9-tetrahydro-5H-pyrimido[5,4-c]azepin-5-one
2-cyclopropyl-6-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]-6,7,8,9-tetrahydro-5H-pyrimido[5,4-c]azepin-5-one
Compound characteristics
| Compound ID: | S529-0340 |
| Compound Name: | 2-cyclopropyl-6-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]-6,7,8,9-tetrahydro-5H-pyrimido[5,4-c]azepin-5-one |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C19 H27 N5 O2 |
| Smiles: | CN1CCCN(CC1)C(CN1CCCc2c(cnc(C3CC3)n2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1217 |
| logD: | -1.0435 |
| logSw: | -1.2328 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.962 |
| InChI Key: | ZVNPSOBKZWYPSQ-UHFFFAOYSA-N |