F1174-1221
TL;DR: F1174-1221 (CAS 315683-63-7) is a chemical compound with molecular formula C22H18ClN3O3S3 and molecular weight 503.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-chloro-2-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]-4-phenylthiophene-3-carboxylate
Also Known As: F1174-1221, METHYL 5-CHLORO-2-[2-({5,6-DIMETHYLTHIENO[2,3-D]PYRIMIDIN-4-YL}SULFANYL)ACETAMIDO]-4-PHENYLTHIOPHENE-3-CARBOXYLATE, methyl 5-chloro-2-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]-4-phenylthiophene-3-carboxylate, methyl 5-chloro-2-({[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetyl}amino)-4-phenylthiophene-3-carboxylate, methyl 5-chloro-2-(2-((5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio)acetamido)-4-phenylthiophene-3-carboxylate
| Molecular Formula | C22H18ClN3O3S3 |
|---|---|
| Molecular Weight | 503.02 g/mol |
| LogP | 6.20744 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.0199 |
| Heavy Atoms | 32 |
| Complexity | 1318.4524 |
Chemical Identifiers
| CAS Number | 315683-63-7 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC3=C(C(=C(S3)Cl)C4=CC=CC=C4)C(=O)OC)C |
Product Overview
F1174-1221 (CAS 315683-63-7), with molecular formula C22H18ClN3O3S3 and molecular weight 503.02 g/mol. IUPAC: methyl 5-chloro-2-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]-4-phenylthiophene-3-carboxylate.
Chemical Property Profile of F1174-1221
Property Insights of F1174-1221
The XLogP value of 6.20744 indicates that F1174-1221 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 F1174-1221. Following Lipinski's Rule of Five, F1174-1221 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 F1174-1221?
The CAS number of F1174-1221 is 315683-63-7.
What is the molecular formula of F1174-1221?
The molecular formula of F1174-1221 is C22H18ClN3O3S3.
What is the molecular weight of F1174-1221?
The molecular weight of F1174-1221 is 503.02 g/mol.
Where can I buy F1174-1221?
You can request a quote for F1174-1221 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1174-1221?
Yes, KEHONG BIO provides custom synthesis services for F1174-1221 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.