BAS 02102890
TL;DR: BAS 02102890 (CAS 340272-35-7) is a chemical compound with molecular formula C23H21N3O4 and molecular weight 403.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxoprop-1-enyl]-2,5-dimethylpyrrol-1-yl]benzoate
Also Known As: BAS 02102890, (E)-methyl 4-(3-(2-cyano-3-((furan-2-ylmethyl)amino)-3-oxoprop-1-en-1-yl)-2,5-dimethyl-1H-pyrrol-1-yl)benzoate, methyl 4-(3-{(1E)-2-cyano-2-[N-(2-furylmethyl)carbamoyl]vinyl}-2,5-dimethylpyr rolyl)benzoate, methyl 4-(3-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate, methyl 4-[3-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxoprop-1-enyl]-2,5-dimethylpyrrol-1-yl]benzoate
| Molecular Formula | C23H21N3O4 |
|---|---|
| Molecular Weight | 403.15 g/mol |
| LogP | 3.69712 |
| Topological Polar Surface Area | 97.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.1532 |
| Heavy Atoms | 30 |
| Complexity | 1130.5742 |
Chemical Identifiers
| CAS Number | 340272-35-7 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)/C=C(\C#N)/C(=O)NCC3=CC=CO3 |
Product Overview
BAS 02102890 (CAS 340272-35-7), with molecular formula C23H21N3O4 and molecular weight 403.15 g/mol. IUPAC: methyl 4-[3-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxoprop-1-enyl]-2,5-dimethylpyrrol-1-yl]benzoate.
Chemical Property Profile of BAS 02102890
Property Insights of BAS 02102890
The XLogP value of 3.69712 indicates that BAS 02102890 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.26 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02102890. Following Lipinski's Rule of Five, BAS 02102890 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 BAS 02102890?
The CAS number of BAS 02102890 is 340272-35-7.
What is the molecular formula of BAS 02102890?
The molecular formula of BAS 02102890 is C23H21N3O4.
What is the molecular weight of BAS 02102890?
The molecular weight of BAS 02102890 is 403.15 g/mol.
Where can I buy BAS 02102890?
You can request a quote for BAS 02102890 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02102890?
Yes, KEHONG BIO provides custom synthesis services for BAS 02102890 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.