BRD-K34351634-001-01-4
TL;DR: BRD-K34351634-001-01-4 (CAS 329078-00-4) is a chemical compound with molecular formula C18H18FNO3S and molecular weight 347.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-ethyl-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate
Also Known As: BRD-K34351634-001-01-4, methyl 4-ethyl-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate, methyl 4-ethyl-2-{[3-(4-fluorophenyl)acryloyl]amino}-5-methyl-3-thiophenecarboxylate, methyl 2-[(2E)-3-(4-fluorophenyl)prop-2-enoylamino]-4-ethyl-5-methylthiophene- 3-carboxylate, methyl 4-ethyl-2-{[(2E)-3-(4-fluorophenyl)prop-2-enoyl]amino}-5-methylthiophene-3-carboxylate
| Molecular Formula | C18H18FNO3S |
|---|---|
| Molecular Weight | 347.10 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.09915 |
| Heavy Atoms | 24 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 329078-00-4 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OC)NC(=O)/C=C/C2=CC=C(C=C2)F)C |
| InChIKey | OFFPKTLYRLCUQD-JXMROGBWSA-N |
Product Overview
BRD-K34351634-001-01-4 (CAS 329078-00-4), with molecular formula C18H18FNO3S and molecular weight 347.10 g/mol. IUPAC: methyl 4-ethyl-2-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of BRD-K34351634-001-01-4
Property Insights of BRD-K34351634-001-01-4
The XLogP value of 4.9 indicates that BRD-K34351634-001-01-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K34351634-001-01-4. Following Lipinski's Rule of Five, BRD-K34351634-001-01-4 has 1 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 BRD-K34351634-001-01-4?
The CAS number of BRD-K34351634-001-01-4 is 329078-00-4.
What is the molecular formula of BRD-K34351634-001-01-4?
The molecular formula of BRD-K34351634-001-01-4 is C18H18FNO3S.
What is the molecular weight of BRD-K34351634-001-01-4?
The molecular weight of BRD-K34351634-001-01-4 is 347.10 g/mol.
Where can I buy BRD-K34351634-001-01-4?
You can request a quote for BRD-K34351634-001-01-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K34351634-001-01-4?
Yes, KEHONG BIO provides custom synthesis services for BRD-K34351634-001-01-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.