BAS 00101156
TL;DR: BAS 00101156 (CAS 608510-47-0) is a chemical compound with molecular formula C17H21N3O6 and molecular weight 363.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00101156, Pentyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, (7-(2,2-dimethylpropanamido)-4,6-dimethyl-1-octylindolin-5-yl)acetic acid hemisulfate, pentyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, 4-(4-Hydroxy-3-nitro-phenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid pentyl ester
| Molecular Formula | C17H21N3O6 |
|---|---|
| Molecular Weight | 363.14 g/mol |
| LogP | 2.6617 |
| Topological Polar Surface Area | 130.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 363.14304 |
| Heavy Atoms | 26 |
| Complexity | 758.8652 |
Chemical Identifiers
| CAS Number | 608510-47-0 |
|---|---|
| SMILES | CCCCCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)O)[N+](=O)[O-])C |
Product Overview
BAS 00101156 (CAS 608510-47-0), with molecular formula C17H21N3O6 and molecular weight 363.14 g/mol. IUPAC: pentyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00101156
Property Insights of BAS 00101156
The XLogP value of 2.6617 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00101156. The TPSA of 130.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00101156. Following Lipinski's Rule of Five, BAS 00101156 has 3 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 BAS 00101156?
The CAS number of BAS 00101156 is 608510-47-0.
What is the molecular formula of BAS 00101156?
The molecular formula of BAS 00101156 is C17H21N3O6.
What is the molecular weight of BAS 00101156?
The molecular weight of BAS 00101156 is 363.14 g/mol.
Where can I buy BAS 00101156?
You can request a quote for BAS 00101156 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00101156?
Yes, KEHONG BIO provides custom synthesis services for BAS 00101156 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.