BAS 06738981
TL;DR: BAS 06738981 (CAS 677754-31-3) is a chemical compound with molecular formula C21H19FN2O6S and molecular weight 446.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoroanilino]-N-(furan-2-ylmethyl)acetamide
Also Known As: BAS 06738981, 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoroanilino]-N-(furan-2-ylmethyl)acetamide, 2-(N-(4-fluorophenyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-sulfonamido)-N-(furan-2-ylmethyl)acetamide, 2-[(2H,3H-benzo[3,4-e]1,4-dioxin-6-ylsulfonyl)(4-fluorophenyl)amino]-N-(2-fury lmethyl)acetamide, N~2~-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N~2~-(4-fluorophenyl)-N-(furan-2-ylmethyl)glycinamide
| Molecular Formula | C21H19FN2O6S |
|---|---|
| Molecular Weight | 446.09 g/mol |
| LogP | 2.7016 |
| Topological Polar Surface Area | 98.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.0948 |
| Heavy Atoms | 31 |
| Complexity | 1163.0905 |
Chemical Identifiers
| CAS Number | 677754-31-3 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)S(=O)(=O)N(CC(=O)NCC3=CC=CO3)C4=CC=C(C=C4)F |
Product Overview
BAS 06738981 (CAS 677754-31-3), with molecular formula C21H19FN2O6S and molecular weight 446.09 g/mol. IUPAC: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoroanilino]-N-(furan-2-ylmethyl)acetamide.
Chemical Property Profile of BAS 06738981
Property Insights of BAS 06738981
The XLogP value of 2.7016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06738981. The TPSA of 98.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06738981. Following Lipinski's Rule of Five, BAS 06738981 has 1 hydrogen bond donor(s) and 6 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 06738981?
The CAS number of BAS 06738981 is 677754-31-3.
What is the molecular formula of BAS 06738981?
The molecular formula of BAS 06738981 is C21H19FN2O6S.
What is the molecular weight of BAS 06738981?
The molecular weight of BAS 06738981 is 446.09 g/mol.
Where can I buy BAS 06738981?
You can request a quote for BAS 06738981 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06738981?
Yes, KEHONG BIO provides custom synthesis services for BAS 06738981 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.