Fluorescein-5-thiosemicarbazide
TL;DR: Fluorescein-5-thiosemicarbazide (CAS 76863-28-0) is a chemical compound with molecular formula C21H15N3O5S and molecular weight 421.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)thiourea
Also Known As: Fluorescein-5-thiosemicarbazide, J2.174.515D, 1-amino-3-(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)thiourea, 3-amino-1-(3',6'-dihydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-yl)thiourea, 3-amino-1-{3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-5-yl}thiourea
| Molecular Formula | C21H15N3O5S |
|---|---|
| Molecular Weight | 421.07 g/mol |
| LogP | 2.8259 |
| Topological Polar Surface Area | 126.07 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 421.07324 |
| Heavy Atoms | 30 |
| Complexity | 1191.8066 |
Chemical Identifiers
| CAS Number | 76863-28-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1NC(=S)NN)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O |
Product Overview
Fluorescein-5-thiosemicarbazide (CAS 76863-28-0), with molecular formula C21H15N3O5S and molecular weight 421.07 g/mol. IUPAC: 1-amino-3-(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)thiourea.
Chemical Property Profile of Fluorescein-5-thiosemicarbazide
Property Insights of Fluorescein-5-thiosemicarbazide
The XLogP value of 2.8259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fluorescein-5-thiosemicarbazide. The TPSA of 126.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Fluorescein-5-thiosemicarbazide. Following Lipinski's Rule of Five, Fluorescein-5-thiosemicarbazide has 5 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 Fluorescein-5-thiosemicarbazide?
The CAS number of Fluorescein-5-thiosemicarbazide is 76863-28-0.
What is the molecular formula of Fluorescein-5-thiosemicarbazide?
The molecular formula of Fluorescein-5-thiosemicarbazide is C21H15N3O5S.
What is the molecular weight of Fluorescein-5-thiosemicarbazide?
The molecular weight of Fluorescein-5-thiosemicarbazide is 421.07 g/mol.
Where can I buy Fluorescein-5-thiosemicarbazide?
You can request a quote for Fluorescein-5-thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluorescein-5-thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for Fluorescein-5-thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.