![[(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea structure](/static/products/899/899395-96-1.png)
[(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea
TL;DR: [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea (CAS 899395-96-1) is a chemical compound with molecular formula C12H8N4O3S and molecular weight 288.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-hydroxy-2-oxo-3H-pyrano[3,2-e]indol-1-yl)iminothiourea
Also Known As: [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea|(2E)-2-(2,7-dioxo-2,3-dihydropyrano[3,2-e]indol-1(7H)-ylidene)hydrazinecarbothioamide|(E)-2-(2,7-dioxo-2,3-dihydropyrano[3,2-e]indol-1(7H)-ylidene)hydrazinecarbothioamide
| Molecular Formula | C12H8N4O3S |
|---|---|
| Molecular Weight | 288.03 g/mol |
| LogP | 2.3072 |
| Topological Polar Surface Area | 116.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.0317 |
| Heavy Atoms | 20 |
| Complexity | 925.4833 |
Chemical Identifiers
| CAS Number | 899395-96-1 |
|---|---|
| SMILES | C1=C2C(=CC=C3C2=C(C(=O)N3)N=NC(=S)N)OC(=C1)O |
Product Overview
[(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea (CAS 899395-96-1), with molecular formula C12H8N4O3S and molecular weight 288.03 g/mol. IUPAC: (7-hydroxy-2-oxo-3H-pyrano[3,2-e]indol-1-yl)iminothiourea.
Chemical Property Profile of [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea
Property Insights of [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea
The XLogP value of 2.3072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea. The TPSA of 116.97 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea. Following Lipinski's Rule of Five, [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea 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 [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea?
The CAS number of [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea is 899395-96-1.
What is the molecular formula of [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea?
The molecular formula of [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea is C12H8N4O3S.
What is the molecular weight of [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea?
The molecular weight of [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea is 288.03 g/mol.
Where can I buy [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea?
You can request a quote for [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(2,7-dioxopyrano[3,2-e]indol-1-yl)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.