BIM-0003087.P001
TL;DR: BIM-0003087.P001 (CAS 307541-69-1) is a chemical compound with molecular formula C21H17N3O4S and molecular weight 407.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-methoxyphenyl)-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: BIM-0003087.P001, AB00673123-01, 3-hydroxy-5-(4-methoxyphenyl)-4-(4-methylbenzoyl)-1-(1,3,4-thiadiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-methoxyphenyl)-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione, 3-hydroxy-5-(4-methoxyphenyl)-4-(4-methylbenzoyl)-1-(1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C21H17N3O4S |
|---|---|
| Molecular Weight | 407.09 g/mol |
| LogP | 3.48142 |
| Topological Polar Surface Area | 92.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.09396 |
| Heavy Atoms | 29 |
| Complexity | 1089.9696 |
Chemical Identifiers
| CAS Number | 307541-69-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NN=CS3)C4=CC=C(C=C4)OC)/O |
Product Overview
BIM-0003087.P001 (CAS 307541-69-1), with molecular formula C21H17N3O4S and molecular weight 407.09 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-methoxyphenyl)-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of BIM-0003087.P001
Property Insights of BIM-0003087.P001
The XLogP value of 3.48142 indicates that BIM-0003087.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.62 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0003087.P001. Following Lipinski's Rule of Five, BIM-0003087.P001 has 1 hydrogen bond donor(s) and 7 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 BIM-0003087.P001?
The CAS number of BIM-0003087.P001 is 307541-69-1.
What is the molecular formula of BIM-0003087.P001?
The molecular formula of BIM-0003087.P001 is C21H17N3O4S.
What is the molecular weight of BIM-0003087.P001?
The molecular weight of BIM-0003087.P001 is 407.09 g/mol.
Where can I buy BIM-0003087.P001?
You can request a quote for BIM-0003087.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0003087.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0003087.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.