3-(1,3-benzothiazol-2-yl)-1-(3-{4-[(cyclopropylmethoxy)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-[(cyclopropylmethoxy)methyl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)propan-1-one
3-(1,3-benzothiazol-2-yl)-1-(3-{4-[(cyclopropylmethoxy)methyl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S932-7224 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-(3-{4-[(cyclopropylmethoxy)methyl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C21 H25 N5 O2 S |
| Smiles: | C1CN(CC1n1cc(COCC2CC2)nn1)C(CCc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6736 |
| logD: | 2.6736 |
| logSw: | -2.6529 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.062 |
| InChI Key: | UIJMPFUYJBXTBV-QGZVFWFLSA-N |