4-{[rel-(3R,4S)-4-{[(tert-butoxycarbonyl)amino]methyl}-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}pyrrolidin-3-yl]methoxy}benzoic acid
Chemical Structure Depiction of
4-{[rel-(3R,4S)-4-{[(tert-butoxycarbonyl)amino]methyl}-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}pyrrolidin-3-yl]methoxy}benzoic acid
4-{[rel-(3R,4S)-4-{[(tert-butoxycarbonyl)amino]methyl}-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}pyrrolidin-3-yl]methoxy}benzoic acid
Compound characteristics
| Compound ID: | P207-9065 |
| Compound Name: | 4-{[rel-(3R,4S)-4-{[(tert-butoxycarbonyl)amino]methyl}-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}pyrrolidin-3-yl]methoxy}benzoic acid |
| Molecular Weight: | 572.66 |
| Molecular Formula: | C33 H36 N2 O7 |
| Smiles: | CC(C)(C)OC(NC[C@H]1CN(C[C@@H]1COc1ccc(cc1)C(O)=O)C(=O)OCC1c2ccccc2c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.7725 |
| logD: | 4.2549 |
| logSw: | -5.5772 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.074 |
| InChI Key: | JTIGQPQELZJMAH-PKTZIBPZSA-N |