3-[4-(5-chlorothiophene-2-carbonyl)-1,4-diazepan-1-yl]-1-(cyclopropylmethyl)pyrrolidin-2-one
Chemical Structure Depiction of
3-[4-(5-chlorothiophene-2-carbonyl)-1,4-diazepan-1-yl]-1-(cyclopropylmethyl)pyrrolidin-2-one
3-[4-(5-chlorothiophene-2-carbonyl)-1,4-diazepan-1-yl]-1-(cyclopropylmethyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-1516 |
| Compound Name: | 3-[4-(5-chlorothiophene-2-carbonyl)-1,4-diazepan-1-yl]-1-(cyclopropylmethyl)pyrrolidin-2-one |
| Molecular Weight: | 381.92 |
| Molecular Formula: | C18 H24 Cl N3 O2 S |
| Smiles: | C1CN(CCN(C1)C(c1ccc(s1)[Cl])=O)C1CCN(CC2CC2)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5495 |
| logD: | 2.3611 |
| logSw: | -2.9097 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.11 |
| InChI Key: | XRTVAKNEHJJGAQ-AWEZNQCLSA-N |