(2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide
TL;DR: (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide (CAS 4290-92-0) is a chemical compound with molecular formula C13H16N4OS and molecular weight 276.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-butyl-2-hydroxyindol-3-yl)iminothiourea
Also Known As: [(1-butyl-2-oxoindol-3-ylidene)amino]thiourea|[(E)-(1-butyl-2-oxoindol-3-ylidene)amino]thiourea|[(Z)-(1-butyl-2-oxoindol-3-ylidene)amino]thiourea|(Z)-2-(1-butyl-2-oxoindolin-3-ylidene)hydrazinecarbothioamide|(2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide|{[(3E)-1-BUTYL-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YLIDENE]AMINO}THIOUREA
| Molecular Formula | C13H16N4OS |
|---|---|
| Molecular Weight | 276.10 g/mol |
| LogP | 3.4743 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.1045 |
| Heavy Atoms | 19 |
| Complexity | 632.8501 |
Chemical Identifiers
| CAS Number | 4290-92-0 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2C(=C1O)N=NC(=S)N |
Product Overview
(2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide (CAS 4290-92-0), with molecular formula C13H16N4OS and molecular weight 276.10 g/mol. IUPAC: (1-butyl-2-hydroxyindol-3-yl)iminothiourea.
Chemical Property Profile of (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide
Property Insights of (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide
The XLogP value of 3.4743 indicates that (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide 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 (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide. Following Lipinski's Rule of Five, (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide 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 (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
The CAS number of (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide is 4290-92-0.
What is the molecular formula of (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
The molecular formula of (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide is C13H16N4OS.
What is the molecular weight of (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
The molecular weight of (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide is 276.10 g/mol.
Where can I buy (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
You can request a quote for (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.