BIM-0020468.P001
TL;DR: BIM-0020468.P001 (CAS 330957-08-9) is a chemical compound with molecular formula C25H17N3O5S2 and molecular weight 503.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-[[6-(1,3-dioxoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: BIM-0020468.P001, methyl 2-[({[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetyl)amino]benzoate, A1913/0080410, methyl 2-[[2-[[6-(1,3-dioxoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl]acetyl]amino]benzoate, methyl 2-(2-((6-(1,3-dioxoisoindolin-2-yl)benzo[d]thiazol-2-yl)thio)acetamido)benzoate
| Molecular Formula | C25H17N3O5S2 |
|---|---|
| Molecular Weight | 503.06 g/mol |
| LogP | 4.6143 |
| Topological Polar Surface Area | 105.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.06097 |
| Heavy Atoms | 35 |
| Complexity | 1479.027 |
Chemical Identifiers
| CAS Number | 330957-08-9 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O |
Product Overview
BIM-0020468.P001 (CAS 330957-08-9), with molecular formula C25H17N3O5S2 and molecular weight 503.06 g/mol. IUPAC: methyl 2-[[2-[[6-(1,3-dioxoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of BIM-0020468.P001
Property Insights of BIM-0020468.P001
The XLogP value of 4.6143 indicates that BIM-0020468.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.67 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0020468.P001. Following Lipinski's Rule of Five, BIM-0020468.P001 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0020468.P001?
The CAS number of BIM-0020468.P001 is 330957-08-9.
What is the molecular formula of BIM-0020468.P001?
The molecular formula of BIM-0020468.P001 is C25H17N3O5S2.
What is the molecular weight of BIM-0020468.P001?
The molecular weight of BIM-0020468.P001 is 503.06 g/mol.
Where can I buy BIM-0020468.P001?
You can request a quote for BIM-0020468.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0020468.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0020468.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.