2-(4-ethylpiperazine-1-carbonyl)-3-methyl-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
Chemical Structure Depiction of
2-(4-ethylpiperazine-1-carbonyl)-3-methyl-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
2-(4-ethylpiperazine-1-carbonyl)-3-methyl-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one
Compound characteristics
| Compound ID: | E213-0394 |
| Compound Name: | 2-(4-ethylpiperazine-1-carbonyl)-3-methyl-7,8,9,10-tetrahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-4(6H)-one |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C19 H26 N4 O2 S |
| Smiles: | CCN1CCN(CC1)C(c1c(C)c2C(N3CCCCCC3=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7122 |
| logD: | 1.5424 |
| logSw: | -1.7996 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.807 |
| InChI Key: | HEOUYAAXBVHTNZ-UHFFFAOYSA-N |