BAS 00529588
TL;DR: BAS 00529588 (CAS 1902-40-5) is a chemical compound with molecular formula C20H28N2S6 and molecular weight 488.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methylpropyl(thiophen-2-ylmethyl)carbamothioyl]sulfanyl N-(2-methylpropyl)-N-(thiophen-2-ylmethyl)carbamodithioate
Also Known As: BAS 00529588, 2,2'-(disulfanediylbis{carbonothioyl[(2-methylpropyl)imino]methanediyl})dithiophene, [(2-methylpropyl)(2-thienylmethyl)amino]({[(2-methylpropyl)(2-thienylmethyl)am ino]thioxomethyl}disulfanyl)methane-1-thione, [2-methylpropyl(thiophen-2-ylmethyl)carbamothioyl]sulfanyl N-(2-methylpropyl)-N-(thiophen-2-ylmethyl)carbamodithioate, N-(2-METHYLPROPYL)-N-(THIOPHEN-2-YLMETHYL){[(2-METHYLPROPYL)(THIOPHEN-2-YLMETHYL)CARBAMOTHIOYL]DISULFANYL}CARBOTHIOAMIDE
| Molecular Formula | C20H28N2S6 |
|---|---|
| Molecular Weight | 488.06 g/mol |
| LogP | 7.377 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 488.05768 |
| Heavy Atoms | 28 |
| Complexity | 646.9011 |
Chemical Identifiers
| CAS Number | 1902-40-5 |
|---|---|
| SMILES | CC(C)CN(CC1=CC=CS1)C(=S)SSC(=S)N(CC2=CC=CS2)CC(C)C |
Product Overview
BAS 00529588 (CAS 1902-40-5), with molecular formula C20H28N2S6 and molecular weight 488.06 g/mol. IUPAC: [2-methylpropyl(thiophen-2-ylmethyl)carbamothioyl]sulfanyl N-(2-methylpropyl)-N-(thiophen-2-ylmethyl)carbamodithioate.
Chemical Property Profile of BAS 00529588
Property Insights of BAS 00529588
The XLogP value of 7.377 indicates that BAS 00529588 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, BAS 00529588 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00529588 has 0 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 00529588?
The CAS number of BAS 00529588 is 1902-40-5.
What is the molecular formula of BAS 00529588?
The molecular formula of BAS 00529588 is C20H28N2S6.
What is the molecular weight of BAS 00529588?
The molecular weight of BAS 00529588 is 488.06 g/mol.
Where can I buy BAS 00529588?
You can request a quote for BAS 00529588 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00529588?
Yes, KEHONG BIO provides custom synthesis services for BAS 00529588 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.