AB00105276-01
TL;DR: AB00105276-01 (CAS 6324-77-2) is a chemical compound with molecular formula C17H21N3O3S and molecular weight 347.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-(diethylamino)-2-hydroxyphenyl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AB00105276-01, 5-[4-(diethylamino)-2-hydroxybenzylidene]-1,3-dimethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione, 5-[[4-(diethylamino)-2-hydroxyphenyl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-{[4-(Diethylamino)-2-hydroxyphenyl]methylidene}-1,3-dimethyl-2-sulfanylidenedihydropyrimidine-4,6(1H,5H)-dione, 5-[4-(diethylamino)-2-hydroxybenzylidene]-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C17H21N3O3S |
|---|---|
| Molecular Weight | 347.13 g/mol |
| LogP | 1.8371 |
| Topological Polar Surface Area | 64.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.13037 |
| Heavy Atoms | 24 |
| Complexity | 699.791 |
Chemical Identifiers
| CAS Number | 6324-77-2 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)C=C2C(=O)N(C(=S)N(C2=O)C)C)O |
Product Overview
AB00105276-01 (CAS 6324-77-2), with molecular formula C17H21N3O3S and molecular weight 347.13 g/mol. IUPAC: 5-[[4-(diethylamino)-2-hydroxyphenyl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of AB00105276-01
Property Insights of AB00105276-01
The XLogP value of 1.8371 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00105276-01. The TPSA of 64.09 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00105276-01. Following Lipinski's Rule of Five, AB00105276-01 has 1 hydrogen bond donor(s) and 5 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 AB00105276-01?
The CAS number of AB00105276-01 is 6324-77-2.
What is the molecular formula of AB00105276-01?
The molecular formula of AB00105276-01 is C17H21N3O3S.
What is the molecular weight of AB00105276-01?
The molecular weight of AB00105276-01 is 347.13 g/mol.
Where can I buy AB00105276-01?
You can request a quote for AB00105276-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00105276-01?
Yes, KEHONG BIO provides custom synthesis services for AB00105276-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.