TL;DR: 3-(Indol-3-YL) lactate (CAS 101312-07-6) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-hydroxy-3-(1H-indol-3-yl)propanoic acid
Also Known As: Indolelactate, Indolelactic acid, indole-3-l-lactic acid, DL-3-indolelactate, L-Indole-3-lactic acid
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H11NO3 |
| Molecular Weight | 205.0739 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 73.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.0739 Da |
| Heavy Atoms | 15 |
| Complexity | 244.0 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)O |
| InChIKey | XGILAAMKEQUXLS-JTQLQIEISA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Indol-3-YL) lactate. The TPSA of 73.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Indol-3-YL) lactate. Following Lipinski's Rule of Five, 3-(Indol-3-YL) lactate has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(Indol-3-YL) lactate is 101312-07-6.
The molecular formula of 3-(Indol-3-YL) lactate is C11H11NO3.
The molecular weight of 3-(Indol-3-YL) lactate is 205.0739 g/mol.
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