3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺
TL;DR: 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 (CAS 6976-80-3) is a chemical compound with molecular formula C9H14N4O2 and molecular weight 210.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺
3-(butylcarbamoylamino)-2-cyanoprop-2-enamide
Also Known As: 3-(butylcarbamoylamino)-2-cyanoprop-2-enamide, 3-[(butylcarbamoyl)amino]-2-cyanoprop-2-enamide, 2-Propenamide,3-[[(butylamino)carbonyl]amino]-2-cyano-, (Z)-3-(BUTYLCARBAMOYLAMINO)-2-CYANO-PROP-2-ENAMIDE
| Molecular Formula | C9H14N4O2 |
|---|---|
| Molecular Weight | 210.11 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.11168 |
| Heavy Atoms | 15 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 6976-80-3 |
|---|---|
| SMILES | CCCCNC(=O)NC=C(C#N)C(=O)N |
| InChIKey | VPJUVOFFJJNPNO-UHFFFAOYSA-N |
Product Overview
3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 (CAS 6976-80-3), with molecular formula C9H14N4O2 and molecular weight 210.11 g/mol. IUPAC: 3-(butylcarbamoylamino)-2-cyanoprop-2-enamide.
Chemical Property Profile of 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺
Property Insights of 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺. Following Lipinski's Rule of Five, 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 has 3 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 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺?
The CAS number of 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 is 6976-80-3.
What is the molecular formula of 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺?
The molecular formula of 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 is C9H14N4O2.
What is the molecular weight of 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺?
The molecular weight of 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 is 210.11 g/mol.
Where can I buy 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺?
You can request a quote for 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺?
Yes, KEHONG BIO provides custom synthesis services for 3-(丁基氨基甲酰氨基)-2-氰基丙-2-烯酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.