3-methyl-2-(4-methylpiperazine-1-carbonyl)-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
Chemical Structure Depiction of
3-methyl-2-(4-methylpiperazine-1-carbonyl)-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
3-methyl-2-(4-methylpiperazine-1-carbonyl)-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
Compound characteristics
| Compound ID: | E213-0349 |
| Compound Name: | 3-methyl-2-(4-methylpiperazine-1-carbonyl)-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one |
| Molecular Weight: | 360.48 |
| Molecular Formula: | C18 H24 N4 O2 S |
| Smiles: | Cc1c2C(N3CCCCCC3=Nc2sc1C(N1CCN(C)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3675 |
| logD: | 1.2418 |
| logSw: | -1.5598 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.747 |
| InChI Key: | SXVZGLLHAAXIPV-UHFFFAOYSA-N |