BAS 00297600
TL;DR: BAS 00297600 (CAS 316358-63-1) is a chemical compound with molecular formula C20H21Cl2NO5S and molecular weight 457.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
Also Known As: BAS 00297600, ethyl 2-{[(2,4-dichlorophenoxy)acetyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-(2-(2,4-dichlorophenoxy)acetamido)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate, ethyl 2-[2-(2,4-dichlorophenoxy)acetylamino]-5,5-dimethyl-4,5-dihydro-7H-thiop heno[2,3-c]pyran-3-carboxylate
| Molecular Formula | C20H21Cl2NO5S |
|---|---|
| Molecular Weight | 457.05 g/mol |
| LogP | 5.1004 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 457.05176 |
| Heavy Atoms | 29 |
| Complexity | 941.19305 |
Chemical Identifiers
| CAS Number | 316358-63-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)COC3=C(C=C(C=C3)Cl)Cl |
Product Overview
BAS 00297600 (CAS 316358-63-1), with molecular formula C20H21Cl2NO5S and molecular weight 457.05 g/mol. IUPAC: ethyl 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate.
Chemical Property Profile of BAS 00297600
Property Insights of BAS 00297600
The XLogP value of 5.1004 indicates that BAS 00297600 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00297600. Following Lipinski's Rule of Five, BAS 00297600 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00297600?
The CAS number of BAS 00297600 is 316358-63-1.
What is the molecular formula of BAS 00297600?
The molecular formula of BAS 00297600 is C20H21Cl2NO5S.
What is the molecular weight of BAS 00297600?
The molecular weight of BAS 00297600 is 457.05 g/mol.
Where can I buy BAS 00297600?
You can request a quote for BAS 00297600 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00297600?
Yes, KEHONG BIO provides custom synthesis services for BAS 00297600 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.