1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-
TL;DR: 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- (CAS 31317-52-9) is a chemical compound with molecular formula C19H10N4 and molecular weight 294.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-carbazol-9-ylbuta-1,3-diene-1,1,2-tricarbonitrile
Also Known As: ChemDiv1_019419, 1,8-Dimethyl-dibenzothiophene, 4-carbazol-9-ylbuta-1,3-diene-1,1,2-tricarbonitrile, 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-, 4-(9H-carbazol-9-yl)buta-1,3-diene-1,1,2-tricarbonitrile
| Molecular Formula | C19H10N4 |
|---|---|
| Molecular Weight | 294.09 g/mol |
| LogP | 4.13254 |
| Topological Polar Surface Area | 76.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.09055 |
| Heavy Atoms | 23 |
| Complexity | 1023.0279 |
Chemical Identifiers
| CAS Number | 31317-52-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3N2C=CC(=C(C#N)C#N)C#N |
Product Overview
1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- (CAS 31317-52-9), with molecular formula C19H10N4 and molecular weight 294.09 g/mol. IUPAC: 4-carbazol-9-ylbuta-1,3-diene-1,1,2-tricarbonitrile.
Chemical Property Profile of 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-
Property Insights of 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-
The XLogP value of 4.13254 indicates that 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-. Following Lipinski's Rule of Five, 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- has 0 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 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-?
The CAS number of 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- is 31317-52-9.
What is the molecular formula of 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-?
The molecular formula of 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- is C19H10N4.
What is the molecular weight of 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-?
The molecular weight of 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- is 294.09 g/mol.
Where can I buy 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-?
You can request a quote for 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Butadiene-1,1,2-tricarbonitrile, 4-(9H-carbazol-9-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.