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6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione
TL;DR: 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione (CAS 10055-99-9) is a chemical compound with molecular formula C14H15N3S and molecular weight 257.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione
Also Known As: 6-benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione, 6-Benzyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-4(1H)-thione, 5,7,8-TETRAHYDRO-6-(PHENYLMETHYL)PYRIDO[4,3-D]PYRIMIDINE-4(1H)-THIONE, PYRIDO[4,3-D]PYRIMIDINE-4(3H)-THIONE,5,6,7,8-TETRAHYDRO-6-(PHENYLMETHYL)-
| Molecular Formula | C14H15N3S |
|---|---|
| Molecular Weight | 257.10 g/mol |
| LogP | 2.69749 |
| Topological Polar Surface Area | 31.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.09866 |
| Heavy Atoms | 18 |
| Complexity | 591.48816 |
Chemical Identifiers
| CAS Number | 10055-99-9 |
|---|---|
| SMILES | C1CN(CC2=C1NC=NC2=S)CC3=CC=CC=C3 |
Product Overview
6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione (CAS 10055-99-9), with molecular formula C14H15N3S and molecular weight 257.10 g/mol. IUPAC: 6-benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione.
Chemical Property Profile of 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione
Property Insights of 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione
The XLogP value of 2.69749 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione. With a topological polar surface area (TPSA) of 31.92 Ų, 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione 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 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione?
The CAS number of 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione is 10055-99-9.
What is the molecular formula of 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione?
The molecular formula of 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione is C14H15N3S.
What is the molecular weight of 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione?
The molecular weight of 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione is 257.10 g/mol.
Where can I buy 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione?
You can request a quote for 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.