3-{4-[(2-chlorophenyl)methoxy]phenyl}-6-{3-[4-(3-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
3-{4-[(2-chlorophenyl)methoxy]phenyl}-6-{3-[4-(3-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one
3-{4-[(2-chlorophenyl)methoxy]phenyl}-6-{3-[4-(3-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V020-0030 |
| Compound Name: | 3-{4-[(2-chlorophenyl)methoxy]phenyl}-6-{3-[4-(3-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 560.05 |
| Molecular Formula: | C30 H30 Cl N5 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)N1CCN(CC1)C(CCC1C(N=C(c2ccc(cc2)OCc2ccccc2[Cl])NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1419 |
| logD: | 3.2006 |
| logSw: | -4.4571 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.732 |
| InChI Key: | FEPIOAIGYYIKPW-UHFFFAOYSA-N |