BAS 09858900
TL;DR: BAS 09858900 (CAS 846602-05-9) is a chemical compound with molecular formula C16H16N4O4S2 and molecular weight 392.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide
Also Known As: BAS 09858900, N-(5-((2-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide, N-[5-({[(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]CYCLOPROPANECARBOXAMIDE, N-[5-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide
| Molecular Formula | C16H16N4O4S2 |
|---|---|
| Molecular Weight | 392.06 g/mol |
| LogP | 2.3886 |
| Topological Polar Surface Area | 102.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.0613 |
| Heavy Atoms | 26 |
| Complexity | 837.4073 |
Chemical Identifiers
| CAS Number | 846602-05-9 |
|---|---|
| SMILES | C1CC1C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC4=C(C=C3)OCCO4 |
Product Overview
BAS 09858900 (CAS 846602-05-9), with molecular formula C16H16N4O4S2 and molecular weight 392.06 g/mol. IUPAC: N-[5-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide.
Chemical Property Profile of BAS 09858900
Property Insights of BAS 09858900
The XLogP value of 2.3886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09858900. The TPSA of 102.44 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09858900. Following Lipinski's Rule of Five, BAS 09858900 has 2 hydrogen bond donor(s) and 8 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 09858900?
The CAS number of BAS 09858900 is 846602-05-9.
What is the molecular formula of BAS 09858900?
The molecular formula of BAS 09858900 is C16H16N4O4S2.
What is the molecular weight of BAS 09858900?
The molecular weight of BAS 09858900 is 392.06 g/mol.
Where can I buy BAS 09858900?
You can request a quote for BAS 09858900 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09858900?
Yes, KEHONG BIO provides custom synthesis services for BAS 09858900 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.