2-(3-chloro-6-oxo-6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)-N-(3,5-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-(3-chloro-6-oxo-6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)-N-(3,5-dimethylphenyl)acetamide
2-(3-chloro-6-oxo-6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)-N-(3,5-dimethylphenyl)acetamide
Compound characteristics
Compound ID: | C795-0614 |
Compound Name: | 2-(3-chloro-6-oxo-6a,7,8,9-tetrahydropyrido[3,2-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)-N-(3,5-dimethylphenyl)acetamide |
Molecular Weight: | 384.86 |
Molecular Formula: | C20 H21 Cl N4 O2 |
Smiles: | Cc1cc(C)cc(c1)NC(CN1C(C2CCCN2c2c1cc(cn2)[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3134 |
logD: | 3.3133 |
logSw: | -3.5804 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.728 |
InChI Key: | IQRFIADJVJGYGX-MRXNPFEDSA-N |