1-ethoxy-pent-2-yne
TL;DR: 1-ethoxy-pent-2-yne (CAS 206350-07-4) is a chemical compound with molecular formula C19H18ClF2N5O2 and molecular weight 421.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-chloro-N-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]benzamide
Also Known As: 1-ethoxy-pent-2-yne, 2-AMINO-4-CHLORO-N-[(1R,2R)-2-(2,4-DIFLUOROPHENYL)-2-HYDROXY-1-METHYL-3-(1H-1,2,4-TRIAZOL-1-YL)PROPYL]BENZAMIDE, 2-amino-4-chloro-N-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]benzamide, [R-(R*,R*)]-2-Amino-4-chloro-N-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]benzamide, (1R,2R)-2-Amino-4-chloro-N-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]benzamide
| Molecular Formula | C19H18ClF2N5O2 |
|---|---|
| Molecular Weight | 421.11 g/mol |
| LogP | 2.4982 |
| Topological Polar Surface Area | 106.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.1117 |
| Heavy Atoms | 29 |
| Complexity | 1031.4438 |
Chemical Identifiers
| CAS Number | 206350-07-4 |
|---|---|
| SMILES | C[C@H]([C@](CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)NC(=O)C3=C(C=C(C=C3)Cl)N |
Product Overview
1-ethoxy-pent-2-yne (CAS 206350-07-4), with molecular formula C19H18ClF2N5O2 and molecular weight 421.11 g/mol. IUPAC: 2-amino-4-chloro-N-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]benzamide.
Chemical Property Profile of 1-ethoxy-pent-2-yne
Property Insights of 1-ethoxy-pent-2-yne
The XLogP value of 2.4982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-ethoxy-pent-2-yne. The TPSA of 106.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-ethoxy-pent-2-yne. Following Lipinski's Rule of Five, 1-ethoxy-pent-2-yne has 3 hydrogen bond donor(s) and 5 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-ethoxy-pent-2-yne?
The CAS number of 1-ethoxy-pent-2-yne is 206350-07-4.
What is the molecular formula of 1-ethoxy-pent-2-yne?
The molecular formula of 1-ethoxy-pent-2-yne is C19H18ClF2N5O2.
What is the molecular weight of 1-ethoxy-pent-2-yne?
The molecular weight of 1-ethoxy-pent-2-yne is 421.11 g/mol.
Where can I buy 1-ethoxy-pent-2-yne?
You can request a quote for 1-ethoxy-pent-2-yne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-ethoxy-pent-2-yne?
Yes, KEHONG BIO provides custom synthesis services for 1-ethoxy-pent-2-yne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.