9,10-ethano-9,10-dihydroanthracene
TL;DR: 9,10-ethano-9,10-dihydroanthracene (CAS 5675-97-8) is a chemical compound with molecular formula C14H14Cl2N2O2S and molecular weight 344.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3,4-dichlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: 9,10-ethano-9,10-dihydroanthracene, BIM-0027892.P001, ethyl 4-(3,4-dichlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, ethyl 4-(3,4-dichlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ETHYL 4-(3,4-DICHLOROPHENYL)-6-METHYL-2-SULFANYLIDENE-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE
| Molecular Formula | C14H14Cl2N2O2S |
|---|---|
| Molecular Weight | 344.02 g/mol |
| LogP | 3.3493 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.0153 |
| Heavy Atoms | 21 |
| Complexity | 631.4001 |
Chemical Identifiers
| CAS Number | 5675-97-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)Cl)Cl)C |
Product Overview
9,10-ethano-9,10-dihydroanthracene (CAS 5675-97-8), with molecular formula C14H14Cl2N2O2S and molecular weight 344.02 g/mol. IUPAC: ethyl 4-(3,4-dichlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of 9,10-ethano-9,10-dihydroanthracene
Property Insights of 9,10-ethano-9,10-dihydroanthracene
The XLogP value of 3.3493 indicates that 9,10-ethano-9,10-dihydroanthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, 9,10-ethano-9,10-dihydroanthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-ethano-9,10-dihydroanthracene has 2 hydrogen bond donor(s) and 3 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 9,10-ethano-9,10-dihydroanthracene?
The CAS number of 9,10-ethano-9,10-dihydroanthracene is 5675-97-8.
What is the molecular formula of 9,10-ethano-9,10-dihydroanthracene?
The molecular formula of 9,10-ethano-9,10-dihydroanthracene is C14H14Cl2N2O2S.
What is the molecular weight of 9,10-ethano-9,10-dihydroanthracene?
The molecular weight of 9,10-ethano-9,10-dihydroanthracene is 344.02 g/mol.
Where can I buy 9,10-ethano-9,10-dihydroanthracene?
You can request a quote for 9,10-ethano-9,10-dihydroanthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-ethano-9,10-dihydroanthracene?
Yes, KEHONG BIO provides custom synthesis services for 9,10-ethano-9,10-dihydroanthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.