![2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile structure](/static/products/934/934094-36-7.png)
2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile
TL;DR: 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile (CAS 934094-36-7) is a chemical compound with molecular formula C6H3N5S and molecular weight 177.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1,3,4-thiadiazol-2-ylamino)methylidene]propanedinitrile
Also Known As: 2-[(1,3,4-thiadiazol-2-ylamino)methylidene]propanedinitrile, ((2,4,5-THIADIAZOLYLAMINO)METHYLENE)METHANE-1,1-DICARBONITRILE, 2-{[(1,3,4-thiadiazol-2-yl)amino]methylidene}propanedinitrile, 2-(((1,3,4-Thiadiazol-2-yl)amino)methylene)malononitrile, 2-[(1,3,4-thiadiazol-2-ylamino)methylene]propanedinitrile
| Molecular Formula | C6H3N5S |
|---|---|
| Molecular Weight | 177.01 g/mol |
| LogP | 0.88106 |
| Topological Polar Surface Area | 85.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.01091 |
| Heavy Atoms | 12 |
| Complexity | 336.28043 |
Chemical Identifiers
| CAS Number | 934094-36-7 |
|---|---|
| SMILES | C1=NN=C(S1)NC=C(C#N)C#N |
Product Overview
2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile (CAS 934094-36-7), with molecular formula C6H3N5S and molecular weight 177.01 g/mol. IUPAC: 2-[(1,3,4-thiadiazol-2-ylamino)methylidene]propanedinitrile.
Chemical Property Profile of 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile
Property Insights of 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile
The XLogP value of 0.88106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile. The TPSA of 85.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile has 1 hydrogen bond donor(s) and 6 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-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile?
The CAS number of 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile is 934094-36-7.
What is the molecular formula of 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile?
The molecular formula of 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile is C6H3N5S.
What is the molecular weight of 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile?
The molecular weight of 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile is 177.01 g/mol.
Where can I buy 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile?
You can request a quote for 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1,3,4-Thiadiazol-2-ylamino)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.