BAS 01579901
TL;DR: BAS 01579901 (CAS 332393-07-4) is a chemical compound with molecular formula C25H30N4OS2 and molecular weight 466.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-3-heptylsulfanyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Also Known As: BAS 01579901, 1-heptylthio-4-benzyl-4,6,7,8,9,11-hexahydrobenzo[b]thiopheno[3,2-e]1,2,4-tria zolo[4,3-a]pyrimidin-5-one, 4-benzyl-1-(heptylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one, 4-benzyl-1-(heptylthio)-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
| Molecular Formula | C25H30N4OS2 |
|---|---|
| Molecular Weight | 466.19 g/mol |
| LogP | 6.0953 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 466.1861 |
| Heavy Atoms | 32 |
| Complexity | 1272.3127 |
Chemical Identifiers
| CAS Number | 332393-07-4 |
|---|---|
| SMILES | CCCCCCCSC1=NN=C2N1C3=C(C4=C(S3)CCCC4)C(=O)N2CC5=CC=CC=C5 |
Product Overview
BAS 01579901 (CAS 332393-07-4), with molecular formula C25H30N4OS2 and molecular weight 466.19 g/mol. IUPAC: 7-benzyl-3-heptylsulfanyl-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one.
Chemical Property Profile of BAS 01579901
Property Insights of BAS 01579901
The XLogP value of 6.0953 indicates that BAS 01579901 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.19 Ų, BAS 01579901 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01579901 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01579901?
The CAS number of BAS 01579901 is 332393-07-4.
What is the molecular formula of BAS 01579901?
The molecular formula of BAS 01579901 is C25H30N4OS2.
What is the molecular weight of BAS 01579901?
The molecular weight of BAS 01579901 is 466.19 g/mol.
Where can I buy BAS 01579901?
You can request a quote for BAS 01579901 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01579901?
Yes, KEHONG BIO provides custom synthesis services for BAS 01579901 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.