4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸
TL;DR: 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 (CAS 26315-29-7) is a chemical compound with molecular formula C17H14O3S and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸
4-dibenzothiophen-2-yl-2-methyl-4-oxobutanoic acid
Also Known As: 4-(dibenzo[b,d]thiophen-2-yl)-2-methyl-4-oxobutanoic acid, 4-dibenzothiophen-2-yl-2-methyl-4-oxobutanoic acid, 2-Dibenzothiophenebutanoicacid, a-methyl-g-oxo-, 2-Dibenzothiophenebutanoic acid, alpha-methyl-gamma-oxo-, GAMMA-OXO-alpha-METHYL-2-DIBENZOTHIOPHENEBUTYRIC ACID
| Molecular Formula | C17H14O3S |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.06638 |
| Heavy Atoms | 21 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 26315-29-7 |
|---|---|
| SMILES | CC(CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C32)C(=O)O |
| InChIKey | OPCUXHHINRBWIN-UHFFFAOYSA-N |
Product Overview
4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 (CAS 26315-29-7), with molecular formula C17H14O3S and molecular weight 298.07 g/mol. IUPAC: 4-dibenzothiophen-2-yl-2-methyl-4-oxobutanoic acid.
Chemical Property Profile of 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸
Property Insights of 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸
The XLogP value of 4.0 indicates that 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸. Following Lipinski's Rule of Five, 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 has 1 hydrogen bond donor(s) and 4 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 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸?
The CAS number of 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 is 26315-29-7.
What is the molecular formula of 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸?
The molecular formula of 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 is C17H14O3S.
What is the molecular weight of 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸?
The molecular weight of 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 is 298.07 g/mol.
Where can I buy 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸?
You can request a quote for 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸?
Yes, KEHONG BIO provides custom synthesis services for 4-二苯并噻吩-2-基-2-甲基-4-氧代丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.