4-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-5615 |
| Compound Name: | 4-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 465.01 |
| Molecular Formula: | C23 H29 Cl N2 O4 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(CCN(C)C)C(C2CCC2)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4313 |
| logD: | 2.4672 |
| logSw: | -3.588 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.578 |
| InChI Key: | NTJYURMQHCNROS-UHFFFAOYSA-N |