D103-1112
TL;DR: D103-1112 (CAS 866246-65-3) is a chemical compound with molecular formula C15H13N3O3S2 and molecular weight 347.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-methyl-4-oxochromene-2-carboxamide
Also Known As: D103-1112, N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-6-methyl-4-oxo-4H-chromene-2-carboxamide, N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-methyl-4-oxo-chromene-2-carboxamide, N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-methyl-4-oxochromene-2-carboxamide
| Molecular Formula | C15H13N3O3S2 |
|---|---|
| Molecular Weight | 347.04 g/mol |
| LogP | 3.31722 |
| Topological Polar Surface Area | 85.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.03983 |
| Heavy Atoms | 23 |
| Complexity | 933.10693 |
Chemical Identifiers
| CAS Number | 866246-65-3 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)C |
Product Overview
D103-1112 (CAS 866246-65-3), with molecular formula C15H13N3O3S2 and molecular weight 347.04 g/mol. IUPAC: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-methyl-4-oxochromene-2-carboxamide.
Chemical Property Profile of D103-1112
Property Insights of D103-1112
The XLogP value of 3.31722 indicates that D103-1112 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.09 Ų falls within the moderate polarity range, balancing permeability and solubility for D103-1112. Following Lipinski's Rule of Five, D103-1112 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 D103-1112?
The CAS number of D103-1112 is 866246-65-3.
What is the molecular formula of D103-1112?
The molecular formula of D103-1112 is C15H13N3O3S2.
What is the molecular weight of D103-1112?
The molecular weight of D103-1112 is 347.04 g/mol.
Where can I buy D103-1112?
You can request a quote for D103-1112 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D103-1112?
Yes, KEHONG BIO provides custom synthesis services for D103-1112 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.