F1312-0027
TL;DR: F1312-0027 (CAS 1212321-39-5) is a chemical compound with molecular formula C25H21N3O3S2 and molecular weight 475.10245 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(2-methylphenyl)-4,6-dioxo-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Also Known As: F1312-0027, 2-[2-(2-methylphenyl)-4,6-dioxo-3-(thiophen-2-yl)-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile, 2-(4,6-dioxo-3-(thiophen-2-yl)-2-(o-tolyl)tetrahydro-2H-pyrrolo[3,4-d]isoxazol-5(3H)-yl)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile, 2-[2-(2-methylphenyl)-4,6-dioxo-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile, 2-[2-(2-methylphenyl)-4,6-dioxo-3-(thiophen-2-yl)hexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Technical Specifications
| Molecular Formula | C25H21N3O3S2 |
| Molecular Weight | 475.10245 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 475.10245 Da |
| Heavy Atoms | 33 |
| Complexity | 861.0 |
| SMILES | CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=C(C5=C(S4)CCCC5)C#N)C6=CC=CS6 |
| InChIKey | ODKVWSKHQDRQMD-UHFFFAOYSA-N |
Chemical Property Profile of F1312-0027
Property Insights of F1312-0027
The XLogP value of 5.1 indicates that F1312-0027 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F1312-0027. Following Lipinski's Rule of Five, F1312-0027 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of F1312-0027?
The CAS number of F1312-0027 is 1212321-39-5.
What is the molecular formula of F1312-0027?
The molecular formula of F1312-0027 is C25H21N3O3S2.
What is the molecular weight of F1312-0027?
The molecular weight of F1312-0027 is 475.10245 g/mol.
Where can I buy F1312-0027?
You can request a quote for F1312-0027 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F1312-0027?
Yes, CoreyChem provides custom synthesis services for F1312-0027 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.