(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetic acid
Chemical Structure Depiction of
(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetic acid
(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetic acid
Compound characteristics
| Compound ID: | Y042-3053 |
| Compound Name: | (5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetic acid |
| Molecular Weight: | 274.27 |
| Molecular Formula: | C14 H14 N2 O4 |
| Smiles: | C1CC2C(N(CC(O)=O)c3ccccc3C(N2C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -1.0223 |
| logD: | -5.3408 |
| logSw: | -2.2799 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.928 |
| InChI Key: | FLIIRAIAYMHVAC-NSHDSACASA-N |