(2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide
TL;DR: (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide (CAS 28284-09-5) is a chemical compound with molecular formula C9H7N5O3S and molecular weight 265.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxy-5-nitro-1H-indol-3-yl)iminothiourea
Also Known As: 5-nitroisatin-3-thiosemicarbazone, [(5-nitro-2-oxoindol-3-yl)amino]thiourea, J2.025.458K, AB00073983-01, 5-nitro-1H-indole-2,3-dione 3-thiosemicarbazone
| Molecular Formula | C9H7N5O3S |
|---|---|
| Molecular Weight | 265.03 g/mol |
| LogP | 2.109 |
| Topological Polar Surface Area | 129.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.02695 |
| Heavy Atoms | 18 |
| Complexity | 678.1381 |
Chemical Identifiers
| CAS Number | 28284-09-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=C(N2)O)N=NC(=S)N |
Product Overview
(2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide (CAS 28284-09-5), with molecular formula C9H7N5O3S and molecular weight 265.03 g/mol. IUPAC: (2-hydroxy-5-nitro-1H-indol-3-yl)iminothiourea.
Chemical Property Profile of (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide
Property Insights of (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide
The XLogP value of 2.109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide. The TPSA of 129.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide. Following Lipinski's Rule of Five, (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide has 3 hydrogen bond donor(s) and 5 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-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
The CAS number of (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide is 28284-09-5.
What is the molecular formula of (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
The molecular formula of (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide is C9H7N5O3S.
What is the molecular weight of (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
The molecular weight of (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide is 265.03 g/mol.
Where can I buy (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
You can request a quote for (2E)-2-(5-nitro-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-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.