![methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate structure](/static/products/488/488795-73-9.png)
methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate
TL;DR: methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate (CAS 488795-73-9) is a chemical compound with molecular formula C14H16BrN3O3 and molecular weight 353.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylate
Also Known As: methyl 5-bromo-3-(3-isopropylureido)-1H-indole-2-carboxylate, methyl 5-bromo-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylate, methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate
| Molecular Formula | C14H16BrN3O3 |
|---|---|
| Molecular Weight | 353.04 g/mol |
| LogP | 3.2469 |
| Topological Polar Surface Area | 83.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.0375 |
| Heavy Atoms | 21 |
| Complexity | 694.0742 |
Chemical Identifiers
| CAS Number | 488795-73-9 |
|---|---|
| SMILES | CC(C)NC(=O)NC1=C(NC2=C1C=C(C=C2)Br)C(=O)OC |
Product Overview
methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate (CAS 488795-73-9), with molecular formula C14H16BrN3O3 and molecular weight 353.04 g/mol. IUPAC: methyl 5-bromo-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate
Property Insights of methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate
The XLogP value of 3.2469 indicates that methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.22 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate has 3 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 methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate?
The CAS number of methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate is 488795-73-9.
What is the molecular formula of methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate?
The molecular formula of methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate is C14H16BrN3O3.
What is the molecular weight of methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate?
The molecular weight of methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate is 353.04 g/mol.
Where can I buy methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate?
You can request a quote for methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-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 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-bromo-3-[(propan-2-ylcarbamoyl)amino]-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.