BAS 00188211
TL;DR: BAS 00188211 (CAS 304885-48-1) is a chemical compound with molecular formula C32H19N3O4 and molecular weight 509.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-ethynylphenyl)-2-[3-[(3-ethynylphenyl)carbamoyl]phenyl]-1,3-dioxoisoindole-5-carboxamide
Also Known As: BAS 00188211, A0968/0045253, N-(3-ethynylphenyl)-2-[3-[(3-ethynylphenyl)carbamoyl]phenyl]-1,3-dioxoisoindole-5-carboxamide, N-(3-ethynylphenyl)-2-{3-[(3-ethynylphenyl)carbamoyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide, N-(3-ethynylphenyl)(2-{3-[N-(3-ethynylphenyl)carbamoyl]phenyl}-1,3-dioxobenzo[ c]azolin-5-yl)carboxamide
| Molecular Formula | C32H19N3O4 |
|---|---|
| Molecular Weight | 509.14 g/mol |
| LogP | 4.9544 |
| Topological Polar Surface Area | 95.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 509.13754 |
| Heavy Atoms | 39 |
| Complexity | 1774.8784 |
Chemical Identifiers
| CAS Number | 304885-48-1 |
|---|---|
| SMILES | C#CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NC5=CC=CC(=C5)C#C |
Product Overview
BAS 00188211 (CAS 304885-48-1), with molecular formula C32H19N3O4 and molecular weight 509.14 g/mol. IUPAC: N-(3-ethynylphenyl)-2-[3-[(3-ethynylphenyl)carbamoyl]phenyl]-1,3-dioxoisoindole-5-carboxamide.
Chemical Property Profile of BAS 00188211
Property Insights of BAS 00188211
The XLogP value of 4.9544 indicates that BAS 00188211 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.58 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00188211. Following Lipinski's Rule of Five, BAS 00188211 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00188211?
The CAS number of BAS 00188211 is 304885-48-1.
What is the molecular formula of BAS 00188211?
The molecular formula of BAS 00188211 is C32H19N3O4.
What is the molecular weight of BAS 00188211?
The molecular weight of BAS 00188211 is 509.14 g/mol.
Where can I buy BAS 00188211?
You can request a quote for BAS 00188211 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00188211?
Yes, KEHONG BIO provides custom synthesis services for BAS 00188211 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.