BAS 00288956
TL;DR: BAS 00288956 (CAS 328070-75-3) is a chemical compound with molecular formula C24H26N2O3S and molecular weight 422.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(benzoylcarbamothioylamino)-3-ethyl-3-methyl-4H-naphthalene-2-carboxylate
Also Known As: BAS 00288956, ethyl 1-{[(benzoylamino)carbothioyl]amino}-3-ethyl-3-methyl-3,4-dihydro-2-naphthalenecarboxylate, ethyl 1-(benzoylcarbamothioylamino)-3-ethyl-3-methyl-4H-naphthalene-2-carboxylate, ethyl 1-(3-benzoylthioureido)-3-ethyl-3-methyl-3,4-dihydronaphthalene-2-carboxylate, 1-(3-Benzoyl-thioureido)-3-ethyl-3-methyl-3,4-dihydro-naphthalene-2-carboxylic acid ethyl ester
| Molecular Formula | C24H26N2O3S |
|---|---|
| Molecular Weight | 422.17 g/mol |
| LogP | 4.2377 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.1664 |
| Heavy Atoms | 30 |
| Complexity | 1000.52045 |
Chemical Identifiers
| CAS Number | 328070-75-3 |
|---|---|
| SMILES | CCC1(CC2=CC=CC=C2C(=C1C(=O)OCC)NC(=S)NC(=O)C3=CC=CC=C3)C |
Product Overview
BAS 00288956 (CAS 328070-75-3), with molecular formula C24H26N2O3S and molecular weight 422.17 g/mol. IUPAC: ethyl 1-(benzoylcarbamothioylamino)-3-ethyl-3-methyl-4H-naphthalene-2-carboxylate.
Chemical Property Profile of BAS 00288956
Property Insights of BAS 00288956
The XLogP value of 4.2377 indicates that BAS 00288956 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00288956. Following Lipinski's Rule of Five, BAS 00288956 has 2 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 BAS 00288956?
The CAS number of BAS 00288956 is 328070-75-3.
What is the molecular formula of BAS 00288956?
The molecular formula of BAS 00288956 is C24H26N2O3S.
What is the molecular weight of BAS 00288956?
The molecular weight of BAS 00288956 is 422.17 g/mol.
Where can I buy BAS 00288956?
You can request a quote for BAS 00288956 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00288956?
Yes, KEHONG BIO provides custom synthesis services for BAS 00288956 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.