2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-
TL;DR: 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- (CAS 86717-07-9) 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-(2-methylanilino)propan-2-ol
Also Known As: 1-((5-((2-Indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-2-propanol, 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-, 1-[(5-{[(1H-Indol-3-yl)methyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(2-methylanilino)propan-2-ol, 1-[[5-(1H-indol-3-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-(2-methylanilino)propan-2-ol, 1-[[5-(1H-INDOL-3-YLMETHYLAMINO)-1,3,4-THIADIAZOL-2-YL]SULFANYL]-3-[(2 -METHYLPHENYL)AMINO]PROPAN-2-OL
| 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 | 1077.5768 |
Chemical Identifiers
| CAS Number | 86717-07-9 |
|---|---|
| SMILES | CC1=CC=CC=C1NCC(CSC2=NN=C(S2)NCC3=CNC4=CC=CC=C43)O |
Product Overview
2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- (CAS 86717-07-9), 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-(2-methylanilino)propan-2-ol.
Chemical Property Profile of 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-
Property Insights of 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-
The XLogP value of 4.50502 indicates that 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- 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 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-. Following Lipinski's Rule of Five, 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- 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 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-?
The CAS number of 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- is 86717-07-9.
What is the molecular formula of 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-?
The molecular formula of 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- is C21H23N5OS2.
What is the molecular weight of 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-?
The molecular weight of 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- is 425.13 g/mol.
Where can I buy 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-?
You can request a quote for 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanol, 1-((5-((2-indolylmethyl)amino)-2-thiadiazolyl)thio)-3-(o-toluidino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.