![amino-dimethyl-dioxo-[?]carbonitrile structure](/static/products/7267/72670-25-8.webp)
amino-dimethyl-dioxo-[?]carbonitrile
TL;DR: amino-dimethyl-dioxo-[?]carbonitrile (CAS 72670-25-8) is a chemical compound with molecular formula C19H16N4O2S and molecular weight 364.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-amino-15,19-dimethyl-14,18-dioxo-8-thia-15,19-diazatetracyclo[9.8.0.02,7.012,17]nonadeca-1(11),2,4,6,12,16-hexaene-13-carbonitrile
Also Known As: amino-dimethyl-dioxo-[?]carbonitrile, 4,6-dihydroxy-benzothiazole-2-carbonitrile, 1-Amino-2,12-dimethyl-3,13-dioxo-2,3,5,6,12,13-hexahydro(1)benzothiepino(5,4-c)(2,7)naphthyridine-4-carbonitrile, 1-Amino-2,12-dimethyl-3,13-dioxo-2,3,5,6,12,13-hexahydro[1]benzothiepino[5,4-c][2,7]naphthyridine-4-carbonitrile, 1-amino-2,12-dimethyl-3,13-dioxo-2,3,5,6,12,13-hexahydro-ben
| Molecular Formula | C19H16N4O2S |
|---|---|
| Molecular Weight | 364.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 364.0994 |
| Heavy Atoms | 26 |
| Complexity | 860.0 |
Chemical Identifiers
| CAS Number | 72670-25-8 |
|---|---|
| SMILES | CN1C2=C(CCSC3=CC=CC=C32)C4=C(C(=O)N(C(=C4C1=O)N)C)C#N |
| InChIKey | VBILWVCONRHBHS-UHFFFAOYSA-N |
Product Overview
amino-dimethyl-dioxo-[?]carbonitrile (CAS 72670-25-8), with molecular formula C19H16N4O2S and molecular weight 364.10 g/mol. IUPAC: 16-amino-15,19-dimethyl-14,18-dioxo-8-thia-15,19-diazatetracyclo[9.8.0.02,7.012,17]nonadeca-1(11),2,4,6,12,16-hexaene-13-carbonitrile.
Chemical Property Profile of amino-dimethyl-dioxo-[?]carbonitrile
Property Insights of amino-dimethyl-dioxo-[?]carbonitrile
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for amino-dimethyl-dioxo-[?]carbonitrile. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for amino-dimethyl-dioxo-[?]carbonitrile. Following Lipinski's Rule of Five, amino-dimethyl-dioxo-[?]carbonitrile has 1 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 amino-dimethyl-dioxo-[?]carbonitrile?
The CAS number of amino-dimethyl-dioxo-[?]carbonitrile is 72670-25-8.
What is the molecular formula of amino-dimethyl-dioxo-[?]carbonitrile?
The molecular formula of amino-dimethyl-dioxo-[?]carbonitrile is C19H16N4O2S.
What is the molecular weight of amino-dimethyl-dioxo-[?]carbonitrile?
The molecular weight of amino-dimethyl-dioxo-[?]carbonitrile is 364.10 g/mol.
Where can I buy amino-dimethyl-dioxo-[?]carbonitrile?
You can request a quote for amino-dimethyl-dioxo-[?]carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for amino-dimethyl-dioxo-[?]carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for amino-dimethyl-dioxo-[?]carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.