6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli
TL;DR: 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli (CAS 64232-87-7) is a chemical compound with molecular formula C12H10N4O3S and molecular weight 290.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli, 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanylidene-1H-pyrimidin-4-one, 4(1H)-Pyrimidinone,3-benzodioxol-5-ylmethylene)amino]-2,3-dihydro-2-thioxo-, 4(1H)-PYRIMIDINONE,6-AMINO-5-[(1,3-BENZODIOXOL-5-YLMETHYLENE)AMINO]-2,3-DIHYDRO-2-THIOXO-, 6-Amino-5-{(E)-[(2H-1,3-benzodioxol-5-yl)methylidene]amino}-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
| Molecular Formula | C12H10N4O3S |
|---|---|
| Molecular Weight | 290.05 g/mol |
| LogP | 1.49399 |
| Topological Polar Surface Area | 105.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.04736 |
| Heavy Atoms | 20 |
| Complexity | 809.0802 |
Chemical Identifiers
| CAS Number | 64232-87-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=NC3=C(NC(=S)NC3=O)N |
Product Overview
6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli (CAS 64232-87-7), with molecular formula C12H10N4O3S and molecular weight 290.05 g/mol. IUPAC: 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli
Property Insights of 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli
The XLogP value of 1.49399 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli. The TPSA of 105.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli. Following Lipinski's Rule of Five, 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli has 3 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 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli?
The CAS number of 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli is 64232-87-7.
What is the molecular formula of 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli?
The molecular formula of 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli is C12H10N4O3S.
What is the molecular weight of 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli?
The molecular weight of 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli is 290.05 g/mol.
Where can I buy 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli?
You can request a quote for 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-5-(1,3-benzodioxol-5-ylmethylideneamino)-2-sulfanyli and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.