BAS 00612916
TL;DR: BAS 00612916 (CAS 313969-38-9) is a chemical compound with molecular formula C18H21ClN2O3 and molecular weight 348.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 6-(4-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: BAS 00612916, BIM-0049193.P001, cyclopentyl 4-(4-chlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, cyclopentyl 4-(4-chlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, cyclopentyl 6-(4-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
| Molecular Formula | C18H21ClN2O3 |
|---|---|
| Molecular Weight | 348.12 g/mol |
| LogP | 3.7959 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.12408 |
| Heavy Atoms | 24 |
| Complexity | 678.0092 |
Chemical Identifiers
| CAS Number | 313969-38-9 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1C)C2=CC=C(C=C2)Cl)C(=O)OC3CCCC3 |
Product Overview
BAS 00612916 (CAS 313969-38-9), with molecular formula C18H21ClN2O3 and molecular weight 348.12 g/mol. IUPAC: cyclopentyl 6-(4-chlorophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00612916
Property Insights of BAS 00612916
The XLogP value of 3.7959 indicates that BAS 00612916 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BAS 00612916 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00612916 has 1 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 BAS 00612916?
The CAS number of BAS 00612916 is 313969-38-9.
What is the molecular formula of BAS 00612916?
The molecular formula of BAS 00612916 is C18H21ClN2O3.
What is the molecular weight of BAS 00612916?
The molecular weight of BAS 00612916 is 348.12 g/mol.
Where can I buy BAS 00612916?
You can request a quote for BAS 00612916 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00612916?
Yes, KEHONG BIO provides custom synthesis services for BAS 00612916 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.