BAS 00639464
TL;DR: BAS 00639464 (CAS 1164541-04-1) is a chemical compound with molecular formula C14H18N4O2 and molecular weight 274.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-cyano-2-(dimethylaminomethylideneamino)-5,6,7,8-tetrahydroindolizine-3-carboxylate
Also Known As: BAS 00639464, AB00079455-01, (E)-methyl 1-cyano-2-(((dimethylamino)methylene)amino)-5,6,7,8-tetrahydroindolizine-3-carboxylate, methyl 1-cyano-2-(dimethylaminomethylideneamino)-5,6,7,8-tetrahydroindolizine-3-carboxylate, methyl 1-cyano-2-{[(E)-(dimethylamino)methylidene]amino}-5,6,7,8-tetrahydroindolizine-3-carboxylate
| Molecular Formula | C14H18N4O2 |
|---|---|
| Molecular Weight | 274.14 g/mol |
| LogP | 1.70408 |
| Topological Polar Surface Area | 70.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.14297 |
| Heavy Atoms | 20 |
| Complexity | 593.2956 |
Chemical Identifiers
| CAS Number | 1164541-04-1 |
|---|---|
| SMILES | CN(C)C=NC1=C(N2CCCCC2=C1C#N)C(=O)OC |
Product Overview
BAS 00639464 (CAS 1164541-04-1), with molecular formula C14H18N4O2 and molecular weight 274.14 g/mol. IUPAC: methyl 1-cyano-2-(dimethylaminomethylideneamino)-5,6,7,8-tetrahydroindolizine-3-carboxylate.
Chemical Property Profile of BAS 00639464
Property Insights of BAS 00639464
The XLogP value of 1.70408 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00639464. The TPSA of 70.62 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00639464. Following Lipinski's Rule of Five, BAS 00639464 has 0 hydrogen bond donor(s) and 4 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 BAS 00639464?
The CAS number of BAS 00639464 is 1164541-04-1.
What is the molecular formula of BAS 00639464?
The molecular formula of BAS 00639464 is C14H18N4O2.
What is the molecular weight of BAS 00639464?
The molecular weight of BAS 00639464 is 274.14 g/mol.
Where can I buy BAS 00639464?
You can request a quote for BAS 00639464 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00639464?
Yes, KEHONG BIO provides custom synthesis services for BAS 00639464 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.