1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate
TL;DR: 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate (CAS 473704-64-2) is a chemical compound with molecular formula C21H24N2O5 and molecular weight 384.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-3-(2,3-dimethylindol-1-yl)propan-2-ol;oxalic acid
Also Known As: 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate, 1-anilino-3-(2,3-dimethylindol-1-yl)propan-2-ol;oxalic acid, 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol; oxalic acid, 1-anilino-3-(2,3-dimethylindol-1-yl)propan-2-ol; oxalic acid, IUPAC: 1-anilino-3-(2,3-dimethylindol-1-yl)propan-2-ol; Oxalic Acid
| Molecular Formula | C21H24N2O5 |
|---|---|
| Molecular Weight | 384.17 g/mol |
| LogP | 2.88674 |
| Topological Polar Surface Area | 111.79 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.16852 |
| Heavy Atoms | 28 |
| Complexity | 938.0893 |
Chemical Identifiers
| CAS Number | 473704-64-2 |
|---|---|
| SMILES | CC1=C(N(C2=CC=CC=C12)CC(CNC3=CC=CC=C3)O)C.C(=O)(C(=O)O)O |
Product Overview
1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate (CAS 473704-64-2), with molecular formula C21H24N2O5 and molecular weight 384.17 g/mol. IUPAC: 1-anilino-3-(2,3-dimethylindol-1-yl)propan-2-ol;oxalic acid.
Chemical Property Profile of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate
Property Insights of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate
The XLogP value of 2.88674 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate. The TPSA of 111.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate. Following Lipinski's Rule of Five, 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate?
The CAS number of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate is 473704-64-2.
What is the molecular formula of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate?
The molecular formula of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate is C21H24N2O5.
What is the molecular weight of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate?
The molecular weight of 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate is 384.17 g/mol.
Where can I buy 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate?
You can request a quote for 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-dimethyl-1H-indol-1-yl)-3-(phenylamino)propan-2-ol oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.