F0520-3223
TL;DR: F0520-3223 (CAS 393816-74-5) is a chemical compound with molecular formula C29H30N6O6S3 and molecular weight 654.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[[4-(4-nitrophenyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: F0520-3223, ethyl 2-(2-((4-(4-nitrophenyl)-5-((thiophene-2-carboxamido)methyl)-4H-1,2,4-triazol-3-yl)thio)propanamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ETHYL 2-(2-{[4-(4-NITROPHENYL)-5-{[(THIOPHEN-2-YL)FORMAMIDO]METHYL}-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}PROPANAMIDO)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHENE-3-CARBOXYLATE, ethyl 2-[2-[[4-(4-nitrophenyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
| Molecular Formula | C29H30N6O6S3 |
|---|---|
| Molecular Weight | 654.14 g/mol |
| LogP | 5.7934 |
| Topological Polar Surface Area | 158.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 654.1389 |
| Heavy Atoms | 44 |
| Complexity | 1665.0797 |
Chemical Identifiers
| CAS Number | 393816-74-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C(C)SC3=NN=C(N3C4=CC=C(C=C4)[N+](=O)[O-])CNC(=O)C5=CC=CS5 |
Product Overview
F0520-3223 (CAS 393816-74-5), with molecular formula C29H30N6O6S3 and molecular weight 654.14 g/mol. IUPAC: ethyl 2-[2-[[4-(4-nitrophenyl)-5-[(thiophene-2-carbonylamino)methyl]-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
Chemical Property Profile of F0520-3223
Property Insights of F0520-3223
The XLogP value of 5.7934 indicates that F0520-3223 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 158.35 Ų indicates high polarity, suggesting F0520-3223 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0520-3223 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0520-3223?
The CAS number of F0520-3223 is 393816-74-5.
What is the molecular formula of F0520-3223?
The molecular formula of F0520-3223 is C29H30N6O6S3.
What is the molecular weight of F0520-3223?
The molecular weight of F0520-3223 is 654.14 g/mol.
Where can I buy F0520-3223?
You can request a quote for F0520-3223 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0520-3223?
Yes, KEHONG BIO provides custom synthesis services for F0520-3223 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.