BAS 00351255
TL;DR: BAS 00351255 (CAS 328070-29-7) is a chemical compound with molecular formula C20H16BrNOS3 and molecular weight 460.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)-(4,4,6-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)methanone
Also Known As: BAS 00351255, (4-bromophenyl)(4,4,6-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone, (4-bromophenyl)-(4,4,6-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)methanone, (4-Bromo-phenyl)-(4,4,6-trimethyl-1-thioxo-1,4-dihydro-2,3-dithia-5-aza-cyclopenta[a]naphthalen-5-yl)-methanone, (4-bromophenyl)(4,4,6-trimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)methanone
| Molecular Formula | C20H16BrNOS3 |
|---|---|
| Molecular Weight | 460.96 g/mol |
| LogP | 7.17251 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 460.95773 |
| Heavy Atoms | 26 |
| Complexity | 1079.1809 |
Chemical Identifiers
| CAS Number | 328070-29-7 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C3=C(C(N2C(=O)C4=CC=C(C=C4)Br)(C)C)SSC3=S |
Product Overview
BAS 00351255 (CAS 328070-29-7), with molecular formula C20H16BrNOS3 and molecular weight 460.96 g/mol. IUPAC: (4-bromophenyl)-(4,4,6-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)methanone.
Chemical Property Profile of BAS 00351255
Property Insights of BAS 00351255
The XLogP value of 7.17251 indicates that BAS 00351255 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, BAS 00351255 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00351255 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00351255?
The CAS number of BAS 00351255 is 328070-29-7.
What is the molecular formula of BAS 00351255?
The molecular formula of BAS 00351255 is C20H16BrNOS3.
What is the molecular weight of BAS 00351255?
The molecular weight of BAS 00351255 is 460.96 g/mol.
Where can I buy BAS 00351255?
You can request a quote for BAS 00351255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00351255?
Yes, KEHONG BIO provides custom synthesis services for BAS 00351255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.