RefChem:240399
TL;DR: RefChem:240399 (CAS 101001-39-2) is a chemical compound with molecular formula C27H28N2O4S and molecular weight 476.17697 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butan-2-yl 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrrol-1-yl]acetate
Also Known As: 1-Methylpropyl 2-(4,5-bis(4-methoxyphenyl)-2-thiazolyl)-1H-pyrrole-1-acetate, sec-Butyl 2-(4,5-bis(4-methoxyphenyl)thiazol-2-yl)pyrrole-1-acetate, 1H-Pyrrole-1-acetic acid, 2-(4,5-bis(4-methoxyphenyl)-2-thiazolyl)-, 1-methylpropyl ester, butan-2-yl 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrrol-1-yl]acetate, Butan-2-yl {2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}acetate
Technical Specifications
| Molecular Formula | C27H28N2O4S |
| Molecular Weight | 476.17697 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 90.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 476.17697 Da |
| Heavy Atoms | 34 |
| Complexity | 636.0 |
| SMILES | CCC(C)OC(=O)CN1C=CC=C1C2=NC(=C(S2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC |
| InChIKey | JMIAPOHAZPPTSL-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:240399
Property Insights of RefChem:240399
The XLogP value of 6.0 indicates that RefChem:240399 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:240399. Following Lipinski's Rule of Five, RefChem:240399 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:240399?
The CAS number of RefChem:240399 is 101001-39-2.
What is the molecular formula of RefChem:240399?
The molecular formula of RefChem:240399 is C27H28N2O4S.
What is the molecular weight of RefChem:240399?
The molecular weight of RefChem:240399 is 476.17697 g/mol.
Where can I buy RefChem:240399?
You can request a quote for RefChem:240399 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:240399?
Yes, CoreyChem provides custom synthesis services for RefChem:240399 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.