3-(1,3-benzothiazol-2-yl)-1-(3-{4-[(benzyloxy)methyl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-1-(3-{4-[(benzyloxy)methyl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)propan-1-one
3-(1,3-benzothiazol-2-yl)-1-(3-{4-[(benzyloxy)methyl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S932-7575 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-(3-{4-[(benzyloxy)methyl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C24 H25 N5 O2 S |
| Smiles: | C1CN(CC1n1cc(COCc2ccccc2)nn1)C(CCc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3231 |
| logD: | 3.3231 |
| logSw: | -3.3034 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.539 |
| InChI Key: | YHBADKIWJGCQEN-HXUWFJFHSA-N |