![methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate structure](/static/products/899/899375-63-4.png)
methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate
TL;DR: methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate (CAS 899375-63-4) is a chemical compound with molecular formula C22H25ClN2O4 and molecular weight 416.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate
Also Known As: methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate, methyl 3-((1r,3s,5R,7S)-3-chloroadamantane-1-carboxamido)-6-methoxy-1H-indole-2-carboxylate, methyl 3-{[(3-chlorotricyclo[3.3.1.1~3,7~]dec-1-yl)carbonyl]amino}-6-methoxy-1H-indole-2-carboxylate
| Molecular Formula | C22H25ClN2O4 |
|---|---|
| Molecular Weight | 416.15 g/mol |
| LogP | 4.4794 |
| Topological Polar Surface Area | 80.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.1503 |
| Heavy Atoms | 29 |
| Complexity | 999.65106 |
Chemical Identifiers
| CAS Number | 899375-63-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl |
Product Overview
methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate (CAS 899375-63-4), with molecular formula C22H25ClN2O4 and molecular weight 416.15 g/mol. IUPAC: methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate
Property Insights of methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate
The XLogP value of 4.4794 indicates that methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.42 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 4 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 methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate?
The CAS number of methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate is 899375-63-4.
What is the molecular formula of methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate?
The molecular formula of methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate is C22H25ClN2O4.
What is the molecular weight of methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate?
The molecular weight of methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate is 416.15 g/mol.
Where can I buy methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate?
You can request a quote for methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[(3-chloroadamantane-1-carbonyl)amino]-6-methoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.