ChemDiv2_000212
TL;DR: ChemDiv2_000212 (CAS 353484-30-7) is a chemical compound with molecular formula C19H18BrNO2 and molecular weight 371.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-bromo-1-azapentacyclo[10.6.1.03,7.08,19.013,17]nonadeca-5,8,10,12(19),14-pentaene-2-carboxylic acid
Also Known As: ChemDiv2_000212, BAS 00586473, J3.561.705A, 2-bromo-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-7-carboxylic acid, 10-bromo-1-azapentacyclo[10.6.1.03,7.08,19.013,17]nonadeca-5,8,10,12(19),14-pentaene-2-carboxylic acid
| Molecular Formula | C19H18BrNO2 |
|---|---|
| Molecular Weight | 371.05 g/mol |
| LogP | 4.0553 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 371.0521 |
| Heavy Atoms | 23 |
| Complexity | 751.6283 |
Chemical Identifiers
| CAS Number | 353484-30-7 |
|---|---|
| SMILES | C1C=CC2C1CN3C(C4CC=CC4C5=CC(=CC2=C53)Br)C(=O)O |
Product Overview
ChemDiv2_000212 (CAS 353484-30-7), with molecular formula C19H18BrNO2 and molecular weight 371.05 g/mol. IUPAC: 10-bromo-1-azapentacyclo[10.6.1.03,7.08,19.013,17]nonadeca-5,8,10,12(19),14-pentaene-2-carboxylic acid.
Chemical Property Profile of ChemDiv2_000212
Property Insights of ChemDiv2_000212
The XLogP value of 4.0553 indicates that ChemDiv2_000212 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.54 Ų, ChemDiv2_000212 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_000212 has 1 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 ChemDiv2_000212?
The CAS number of ChemDiv2_000212 is 353484-30-7.
What is the molecular formula of ChemDiv2_000212?
The molecular formula of ChemDiv2_000212 is C19H18BrNO2.
What is the molecular weight of ChemDiv2_000212?
The molecular weight of ChemDiv2_000212 is 371.05 g/mol.
Where can I buy ChemDiv2_000212?
You can request a quote for ChemDiv2_000212 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_000212?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_000212 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.