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[2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea
TL;DR: [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea (CAS 387847-45-2) is a chemical compound with molecular formula C14H18N4OS and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea
Also Known As: [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea|(2Z)-2-[1-(3-methylbutyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinecarbothioamide|AT-057/40524145|[(E)-[1-(3-methylbutyl)-2-oxoindol-3-ylidene]amino]thiourea|1-isopentyl-1H-indole-2,3-dione 3-thiosemicarbazone|[[1-(3-methylbutyl)-2-oxoindol-3-ylidene]amino]thiourea|[(Z)-[1-(3-methylbutyl)-2-oxoindol-3-ylidene]amino]thiourea|(Z)-2-(1-isopentyl-2-oxoindolin-3-ylidene)hydrazinecarbothioamide|3-{[(aminothioxomethyl)amino]azamethylene}-1-(3-methylbutyl)benzo[d]azolidin-2 -one
| Molecular Formula | C14H18N4OS |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 3.7203 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.12012 |
| Heavy Atoms | 20 |
| Complexity | 660.4828 |
Chemical Identifiers
| CAS Number | 387847-45-2 |
|---|---|
| SMILES | CC(C)CCN1C2=CC=CC=C2C(=C1O)N=NC(=S)N |
Product Overview
[2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea (CAS 387847-45-2), with molecular formula C14H18N4OS and molecular weight 290.12 g/mol. IUPAC: [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea.
Chemical Property Profile of [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea
Property Insights of [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea
The XLogP value of 3.7203 indicates that [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea. Following Lipinski's Rule of Five, [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea has 2 hydrogen bond donor(s) and 3 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-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea?
The CAS number of [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea is 387847-45-2.
What is the molecular formula of [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea?
The molecular formula of [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea is C14H18N4OS.
What is the molecular weight of [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea?
The molecular weight of [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea is 290.12 g/mol.
Where can I buy [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea?
You can request a quote for [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea?
Yes, KEHONG BIO provides custom synthesis services for [2-hydroxy-1-(3-methylbutyl)indol-3-yl]iminothiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.