Brn 6010743
TL;DR: Brn 6010743 (CAS 86717-08-0) is a chemical compound with molecular formula C21H23N5OS2 and molecular weight 425.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[5-(1H-indol-3-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-(4-methylanilino)propan-2-ol
Also Known As: 2-Propanol, 1-((5-((1H-indol-3-ylmethyl)amino)-2,3,4-thiadiazol-2-yl)thio)-3-((4-methylphenyl)amino)-, 1-[(5-{[(1H-Indol-3-yl)methyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(4-methylanilino)propan-2-ol, 1-[[5-(1H-indol-3-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-(4-methylanilino)propan-2-ol, BRN 6010743, RefChem:330231
| Molecular Formula | C21H23N5OS2 |
|---|---|
| Molecular Weight | 425.13 g/mol |
| LogP | 4.50502 |
| Topological Polar Surface Area | 85.86 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 425.1344 |
| Heavy Atoms | 29 |
| Complexity | 1060.3268 |
Chemical Identifiers
| CAS Number | 86717-08-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC(CSC2=NN=C(S2)NCC3=CNC4=CC=CC=C43)O |
Product Overview
Brn 6010743 (CAS 86717-08-0), with molecular formula C21H23N5OS2 and molecular weight 425.13 g/mol. IUPAC: 1-[[5-(1H-indol-3-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-(4-methylanilino)propan-2-ol.
Chemical Property Profile of Brn 6010743
Property Insights of Brn 6010743
The XLogP value of 4.50502 indicates that Brn 6010743 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Brn 6010743. Following Lipinski's Rule of Five, Brn 6010743 has 4 hydrogen bond donor(s) and 7 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 Brn 6010743?
The CAS number of Brn 6010743 is 86717-08-0.
What is the molecular formula of Brn 6010743?
The molecular formula of Brn 6010743 is C21H23N5OS2.
What is the molecular weight of Brn 6010743?
The molecular weight of Brn 6010743 is 425.13 g/mol.
Where can I buy Brn 6010743?
You can request a quote for Brn 6010743 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brn 6010743?
Yes, KEHONG BIO provides custom synthesis services for Brn 6010743 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.