BAS 03378821
TL;DR: BAS 03378821 (CAS 442551-08-8) is a chemical compound with molecular formula C26H29FN2O4 and molecular weight 452.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)propyl]-5-(4-fluorophenyl)-4-[hydroxy-(3-methyl-4-prop-2-enoxyphenyl)methylidene]pyrrolidine-2,3-dione
Also Known As: BAS 03378821, 1-[3-(dimethylamino)propyl]-5-(4-fluorophenyl)-3-hydroxy-4-[3-methyl-4-(prop-2-en-1-yloxy)benzoyl]-2,5-dihydro-1H-pyrrol-2-one, 1-[3-(dimethylamino)propyl]-5-(4-fluorophenyl)-4-[hydroxy-(3-methyl-4-prop-2-enoxyphenyl)methylidene]pyrrolidine-2,3-dione
| Molecular Formula | C26H29FN2O4 |
|---|---|
| Molecular Weight | 452.21 g/mol |
| LogP | 4.07232 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 452.21112 |
| Heavy Atoms | 33 |
| Complexity | 1076.1995 |
Chemical Identifiers
| CAS Number | 442551-08-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC=C(C=C3)F)O)OCC=C |
Product Overview
BAS 03378821 (CAS 442551-08-8), with molecular formula C26H29FN2O4 and molecular weight 452.21 g/mol. IUPAC: 1-[3-(dimethylamino)propyl]-5-(4-fluorophenyl)-4-[hydroxy-(3-methyl-4-prop-2-enoxyphenyl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03378821
Property Insights of BAS 03378821
The XLogP value of 4.07232 indicates that BAS 03378821 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 03378821. Following Lipinski's Rule of Five, BAS 03378821 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 03378821?
The CAS number of BAS 03378821 is 442551-08-8.
What is the molecular formula of BAS 03378821?
The molecular formula of BAS 03378821 is C26H29FN2O4.
What is the molecular weight of BAS 03378821?
The molecular weight of BAS 03378821 is 452.21 g/mol.
Where can I buy BAS 03378821?
You can request a quote for BAS 03378821 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03378821?
Yes, KEHONG BIO provides custom synthesis services for BAS 03378821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.