(11aRS)-2-methyl-3,4,9,10,11,11a-hexahydro-1H-pyrrolo[1'',2'':1',2'][1,4]diazepino[5',6':4,5]thieno[2,3-b][1,6]naphthyridine-7,12(2H,13H)-dione
Chemical Structure Depiction of
(11aRS)-2-methyl-3,4,9,10,11,11a-hexahydro-1H-pyrrolo[1'',2'':1',2'][1,4]diazepino[5',6':4,5]thieno[2,3-b][1,6]naphthyridine-7,12(2H,13H)-dione
(11aRS)-2-methyl-3,4,9,10,11,11a-hexahydro-1H-pyrrolo[1'',2'':1',2'][1,4]diazepino[5',6':4,5]thieno[2,3-b][1,6]naphthyridine-7,12(2H,13H)-dione
Compound characteristics
| Compound ID: | 8020-2524 |
| Compound Name: | (11aRS)-2-methyl-3,4,9,10,11,11a-hexahydro-1H-pyrrolo[1'',2'':1',2'][1,4]diazepino[5',6':4,5]thieno[2,3-b][1,6]naphthyridine-7,12(2H,13H)-dione |
| Molecular Weight: | 342.42 |
| Molecular Formula: | C17 H18 N4 O2 S |
| Smiles: | [H][C@]12CCCN2C(c2c(c3cc4CN(C)CCc4nc3s2)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7717 |
| logD: | 0.1627 |
| logSw: | -2.2182 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.348 |
| InChI Key: | FFCQIZCDHLZHHI-GFCCVEGCSA-N |