N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)urea
N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V023-5309 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)urea |
| Molecular Weight: | 534.63 |
| Molecular Formula: | C29 H35 F N6 O3 |
| Salt: | not_available |
| Smiles: | CC(C)NC(N(CC(N1CCCN(CC1)c1ccc(c2cccc(c2)OC)nn1)=O)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9087 |
| logD: | 3.7387 |
| logSw: | -4.0206 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.029 |
| InChI Key: | MFMQESFGBDYGMD-UHFFFAOYSA-N |