F1601-0211
TL;DR: F1601-0211 (CAS 1008036-28-9) is a chemical compound with molecular formula C18H14ClN5O3 and molecular weight 383.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-2-(4,6-dioxo-5-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazol-3-yl)acetamide
Also Known As: F1601-0211, N-(3-chlorophenyl)-2-(4,6-dioxo-5-phenyl-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide, N-(3-chlorophenyl)-2-(4,6-dioxo-5-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazol-3-yl)acetamide, N-(3-chlorophenyl)-2-{4,6-dioxo-5-phenyl-1H,3aH,4H,5H,6H,6aH-pyrrolo[3,4-d][1,2,3]triazol-1-yl}acetamide
| Molecular Formula | C18H14ClN5O3 |
|---|---|
| Molecular Weight | 383.08 g/mol |
| LogP | 2.2719 |
| Topological Polar Surface Area | 94.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.07852 |
| Heavy Atoms | 27 |
| Complexity | 949.0231 |
Chemical Identifiers
| CAS Number | 1008036-28-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C3C(C2=O)N(N=N3)CC(=O)NC4=CC(=CC=C4)Cl |
Product Overview
F1601-0211 (CAS 1008036-28-9), with molecular formula C18H14ClN5O3 and molecular weight 383.08 g/mol. IUPAC: N-(3-chlorophenyl)-2-(4,6-dioxo-5-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazol-3-yl)acetamide.
Chemical Property Profile of F1601-0211
Property Insights of F1601-0211
The XLogP value of 2.2719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1601-0211. The TPSA of 94.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F1601-0211. Following Lipinski's Rule of Five, F1601-0211 has 1 hydrogen bond donor(s) and 6 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 F1601-0211?
The CAS number of F1601-0211 is 1008036-28-9.
What is the molecular formula of F1601-0211?
The molecular formula of F1601-0211 is C18H14ClN5O3.
What is the molecular weight of F1601-0211?
The molecular weight of F1601-0211 is 383.08 g/mol.
Where can I buy F1601-0211?
You can request a quote for F1601-0211 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1601-0211?
Yes, KEHONG BIO provides custom synthesis services for F1601-0211 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.