183C91
TL;DR: 183C91 (CAS 139264-35-0) is a chemical compound with molecular formula C15H19N3O2 and molecular weight 273.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-4-[[3-[2-(methylamino)ethyl]-1H-indol-5-yl]methyl]-1,3-oxazolidin-2-one
Also Known As: N-Desmethyl zolmitriptan, Zolmitriptan Impurity 3, N-Desmethylzolmitriptan, Zolmitriptan USP Rc A, Zolmitriptan EP Impurity G
| Molecular Formula | C15H19N3O2 |
|---|---|
| Molecular Weight | 273.15 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 66.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.14774 |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 139264-35-0 |
|---|---|
| SMILES | CNCCC1=CNC2=C1C=C(C=C2)C[C@H]3COC(=O)N3 |
| InChIKey | QGGCHSMZXKNGCK-LBPRGKRZSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
183C91 (CAS 139264-35-0), with molecular formula C15H19N3O2 and molecular weight 273.15 g/mol. IUPAC: (4S)-4-[[3-[2-(methylamino)ethyl]-1H-indol-5-yl]methyl]-1,3-oxazolidin-2-one.
Chemical Property Profile of 183C91
Property Insights of 183C91
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 183C91. The TPSA of 66.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 183C91. Following Lipinski's Rule of Five, 183C91 has 3 hydrogen bond donor(s) and 3 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 183C91?
The CAS number of 183C91 is 139264-35-0.
What is the molecular formula of 183C91?
The molecular formula of 183C91 is C15H19N3O2.
What is the molecular weight of 183C91?
The molecular weight of 183C91 is 273.15 g/mol.
Where can I buy 183C91?
You can request a quote for 183C91 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 183C91?
Yes, KEHONG BIO provides custom synthesis services for 183C91 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.