BAS 03379398
TL;DR: BAS 03379398 (CAS 440086-94-2) is a chemical compound with molecular formula C27H32N2O4 and molecular weight 448.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy-(2-methyl-4-prop-2-enoxyphenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Also Known As: BAS 03379398, 1-[3-(dimethylamino)propyl]-3-hydroxy-4-[2-methyl-4-(prop-2-en-1-yloxy)benzoyl]-5-(4-methylphenyl)-2,5-dihydro-1H-pyrrol-2-one, (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy-(2-methyl-4-prop-2-enoxyphenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione, 1-[3-(dimethylamino)propyl]-3-hydroxy-5-(4-methylphenyl)-4-{[2-methyl-4-(prop-2-en-1-yloxy)phenyl]carbonyl}-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C27H32N2O4 |
|---|---|
| Molecular Weight | 448.24 g/mol |
| LogP | 4.24164 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 448.2362 |
| Heavy Atoms | 33 |
| Complexity | 1070.0289 |
Chemical Identifiers
| CAS Number | 440086-94-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=C(C=C(C=C3)OCC=C)C)\O)/C(=O)C(=O)N2CCCN(C)C |
Product Overview
BAS 03379398 (CAS 440086-94-2), with molecular formula C27H32N2O4 and molecular weight 448.24 g/mol. IUPAC: (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy-(2-methyl-4-prop-2-enoxyphenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03379398
Property Insights of BAS 03379398
The XLogP value of 4.24164 indicates that BAS 03379398 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03379398. Following Lipinski's Rule of Five, BAS 03379398 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 03379398?
The CAS number of BAS 03379398 is 440086-94-2.
What is the molecular formula of BAS 03379398?
The molecular formula of BAS 03379398 is C27H32N2O4.
What is the molecular weight of BAS 03379398?
The molecular weight of BAS 03379398 is 448.24 g/mol.
Where can I buy BAS 03379398?
You can request a quote for BAS 03379398 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03379398?
Yes, KEHONG BIO provides custom synthesis services for BAS 03379398 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.