BIM-0042576.P001
TL;DR: BIM-0042576.P001 (CAS 312622-77-8) is a chemical compound with molecular formula C19H21N3O7 and molecular weight 403.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: BIM-0042576.P001, cyclopentyl 1,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-3,4-dihydropyrimidine-5-carboxylate, cyclopentyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate, VU0090157, VU 0090157, VU-0090157, cyclopentyl 1,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C19H21N3O7 |
|---|---|
| Molecular Weight | 403.14 g/mol |
| LogP | 2.7794 |
| Topological Polar Surface Area | 120.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.13794 |
| Heavy Atoms | 29 |
| Complexity | 920.623 |
Chemical Identifiers
| CAS Number | 312622-77-8 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1C)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)OC4CCCC4 |
Product Overview
BIM-0042576.P001 (CAS 312622-77-8), with molecular formula C19H21N3O7 and molecular weight 403.14 g/mol. IUPAC: cyclopentyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of BIM-0042576.P001
Property Insights of BIM-0042576.P001
The XLogP value of 2.7794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0042576.P001. The TPSA of 120.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0042576.P001. Following Lipinski's Rule of Five, BIM-0042576.P001 has 1 hydrogen bond donor(s) and 7 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-0042576.P001?
The CAS number of BIM-0042576.P001 is 312622-77-8.
What is the molecular formula of BIM-0042576.P001?
The molecular formula of BIM-0042576.P001 is C19H21N3O7.
What is the molecular weight of BIM-0042576.P001?
The molecular weight of BIM-0042576.P001 is 403.14 g/mol.
Where can I buy BIM-0042576.P001?
You can request a quote for BIM-0042576.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042576.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042576.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.