F1142-2733
TL;DR: F1142-2733 (CAS 452923-37-4) is a chemical compound with molecular formula C27H27N3O3S3 and molecular weight 537.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-methylphenyl)-2-[[2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate
Also Known As: F1142-2733, ethyl 2-(2-((2-methyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)acetamido)-4-(p-tolyl)thiophene-3-carboxylate, ethyl 2-[2-({5-methyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-yl}sulfanyl)acetamido]-4-(4-methylphenyl)thiophene-3-carboxylate, ethyl 4-(4-methylphenyl)-2-[[2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate, ethyl 2-[2-(2-methyl(5,6,7,8-tetrahydrobenzo[b]thiopheno[3,2-e]pyrimidin-4-ylt hio))acetylamino]-4-(4-methylphenyl)thiophene-3-carboxylate
| Molecular Formula | C27H27N3O3S3 |
|---|---|
| Molecular Weight | 537.12 g/mol |
| LogP | 6.82294 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 537.12146 |
| Heavy Atoms | 36 |
| Complexity | 1440.2374 |
Chemical Identifiers
| CAS Number | 452923-37-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)CSC3=NC(=NC4=C3C5=C(S4)CCCC5)C |
Product Overview
F1142-2733 (CAS 452923-37-4), with molecular formula C27H27N3O3S3 and molecular weight 537.12 g/mol. IUPAC: ethyl 4-(4-methylphenyl)-2-[[2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of F1142-2733
Property Insights of F1142-2733
The XLogP value of 6.82294 indicates that F1142-2733 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for F1142-2733. Following Lipinski's Rule of Five, F1142-2733 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1142-2733?
The CAS number of F1142-2733 is 452923-37-4.
What is the molecular formula of F1142-2733?
The molecular formula of F1142-2733 is C27H27N3O3S3.
What is the molecular weight of F1142-2733?
The molecular weight of F1142-2733 is 537.12 g/mol.
Where can I buy F1142-2733?
You can request a quote for F1142-2733 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1142-2733?
Yes, KEHONG BIO provides custom synthesis services for F1142-2733 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.