N-[2-(diethylamino)ethyl]-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)thiourea
Chemical Structure Depiction of
N-[2-(diethylamino)ethyl]-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)thiourea
N-[2-(diethylamino)ethyl]-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)thiourea
Compound characteristics
| Compound ID: | V008-6517 |
| Compound Name: | N-[2-(diethylamino)ethyl]-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N'-(propan-2-yl)thiourea |
| Molecular Weight: | 541.76 |
| Molecular Formula: | C28 H43 N7 O2 S |
| Salt: | not_available |
| Smiles: | CCN(CC)CCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)OC)nn1)=O)C(NC(C)C)=S |
| Stereo: | ACHIRAL |
| logP: | 3.7382 |
| logD: | 0.3043 |
| logSw: | -3.879 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.119 |
| InChI Key: | GWARHACUQMKUOZ-UHFFFAOYSA-N |