BIM-0013008.P001
TL;DR: BIM-0013008.P001 (CAS 6001-84-9) is a chemical compound with molecular formula C26H23N3O6 and molecular weight 473.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-[(E)-[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-2,5-dimethylpyrrol-1-yl]benzoate
Also Known As: BIM-0013008.P001, methyl 4-[3-[(E)-[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-2,5-dimethylpyrrol-1-yl]benzoate, Methyl 4-(3-{(E)-[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
| Molecular Formula | C26H23N3O6 |
|---|---|
| Molecular Weight | 473.16 g/mol |
| LogP | 3.55574 |
| Topological Polar Surface Area | 106.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.1587 |
| Heavy Atoms | 35 |
| Complexity | 1367.3186 |
Chemical Identifiers
| CAS Number | 6001-84-9 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)/C=C/3\C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)OC |
Product Overview
BIM-0013008.P001 (CAS 6001-84-9), with molecular formula C26H23N3O6 and molecular weight 473.16 g/mol. IUPAC: methyl 4-[3-[(E)-[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-2,5-dimethylpyrrol-1-yl]benzoate.
Chemical Property Profile of BIM-0013008.P001
Property Insights of BIM-0013008.P001
The XLogP value of 3.55574 indicates that BIM-0013008.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0013008.P001. Following Lipinski's Rule of Five, BIM-0013008.P001 has 1 hydrogen bond donor(s) and 6 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-0013008.P001?
The CAS number of BIM-0013008.P001 is 6001-84-9.
What is the molecular formula of BIM-0013008.P001?
The molecular formula of BIM-0013008.P001 is C26H23N3O6.
What is the molecular weight of BIM-0013008.P001?
The molecular weight of BIM-0013008.P001 is 473.16 g/mol.
Where can I buy BIM-0013008.P001?
You can request a quote for BIM-0013008.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0013008.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0013008.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.