BIM-0013295.P001
TL;DR: BIM-0013295.P001 (CAS 54962-61-7) is a chemical compound with molecular formula C18H16ClNO2 and molecular weight 313.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-chloro-2-methylphenyl)-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione
Also Known As: BIM-0013295.P001, A0493/0022889, 2-(3-chloro-2-methylphenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 2-(3-chloro-2-methylphenyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 4-(3-CHLORO-2-METHYLPHENYL)-4-AZATETRACYCLO[5.3.2.0(2),?.0?,(1)?]DODEC-11-ENE-3,5-DIONE
| Molecular Formula | C18H16ClNO2 |
|---|---|
| Molecular Weight | 313.09 g/mol |
| LogP | 3.20592 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.08694 |
| Heavy Atoms | 22 |
| Complexity | 719.4541 |
Chemical Identifiers
| CAS Number | 54962-61-7 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)C3C4C=CC(C3C2=O)C5C4C5 |
Product Overview
BIM-0013295.P001 (CAS 54962-61-7), with molecular formula C18H16ClNO2 and molecular weight 313.09 g/mol. IUPAC: 4-(3-chloro-2-methylphenyl)-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione.
Chemical Property Profile of BIM-0013295.P001
Property Insights of BIM-0013295.P001
The XLogP value of 3.20592 indicates that BIM-0013295.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, BIM-0013295.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0013295.P001 has 0 hydrogen bond donor(s) and 2 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 BIM-0013295.P001?
The CAS number of BIM-0013295.P001 is 54962-61-7.
What is the molecular formula of BIM-0013295.P001?
The molecular formula of BIM-0013295.P001 is C18H16ClNO2.
What is the molecular weight of BIM-0013295.P001?
The molecular weight of BIM-0013295.P001 is 313.09 g/mol.
Where can I buy BIM-0013295.P001?
You can request a quote for BIM-0013295.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0013295.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0013295.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.