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BAS 00316176 structure
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BAS 00316176

TL;DR: BAS 00316176 (CAS 164410-94-0) is a chemical compound with molecular formula C16H17N5O2 and molecular weight 311.1382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-methyl-9-(4-methylphenyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione

Also Known As: BAS 00316176, 1-Methyl-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, 1-methyl-9-(p-tolyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, F0372-0790, 1-methyl-9-(4-methylphenyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione

CAS Number
164410-94-0
Molecular Formula
C16H17N5O2
Molecular Weight
311.1382 g/mol
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Technical Specifications

Molecular FormulaC16H17N5O2
Molecular Weight311.1382 g/mol
XLogP1.8
Topological Polar Surface Area (TPSA)70.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass311.1382 Da
Heavy Atoms23
Complexity505.0
SMILESCC1=CC=C(C=C1)N2CCCN3C2=NC4=C3C(=O)NC(=O)N4C
InChIKeyWNXWYCNZVRRYSP-UHFFFAOYSA-N

Chemical Property Profile of BAS 00316176

XLogP
1.8
TPSA (Topological Polar Surface Area)
70.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
23
Complexity
505.0
Exact Mass
311.1382
Monoisotopic Mass
311.1382
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of BAS 00316176

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00316176. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00316176. Following Lipinski's Rule of Five, BAS 00316176 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of BAS 00316176?

The CAS number of BAS 00316176 is 164410-94-0.

What is the molecular formula of BAS 00316176?

The molecular formula of BAS 00316176 is C16H17N5O2.

What is the molecular weight of BAS 00316176?

The molecular weight of BAS 00316176 is 311.1382 g/mol.

Where can I buy BAS 00316176?

You can request a quote for BAS 00316176 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for BAS 00316176?

Yes, CoreyChem provides custom synthesis services for BAS 00316176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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