BAS 00744654
TL;DR: BAS 00744654 (CAS 321730-77-2) is a chemical compound with molecular formula C18H18N4S and molecular weight 322.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(4-methylphenyl)methylideneamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
Also Known As: BAS 00744654, 4-[2-(4-Methylbenzylidene)hydrazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine, 4-ME-BENZALDEHYDE 5,6,7,8-TETRAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-4-YLHYDRAZONE, N-[(E)-p-tolylmethyleneamino]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine, (E)-4-(2-(4-methylbenzylidene)hydrazinyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine
| Molecular Formula | C18H18N4S |
|---|---|
| Molecular Weight | 322.13 g/mol |
| LogP | 4.32452 |
| Topological Polar Surface Area | 50.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.1252 |
| Heavy Atoms | 23 |
| Complexity | 864.609 |
Chemical Identifiers
| CAS Number | 321730-77-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=N/NC2=C3C4=C(CCCC4)SC3=NC=N2 |
Product Overview
BAS 00744654 (CAS 321730-77-2), with molecular formula C18H18N4S and molecular weight 322.13 g/mol. IUPAC: N-[(E)-(4-methylphenyl)methylideneamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of BAS 00744654
Property Insights of BAS 00744654
The XLogP value of 4.32452 indicates that BAS 00744654 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.17 Ų, BAS 00744654 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00744654 has 1 hydrogen bond donor(s) and 5 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 00744654?
The CAS number of BAS 00744654 is 321730-77-2.
What is the molecular formula of BAS 00744654?
The molecular formula of BAS 00744654 is C18H18N4S.
What is the molecular weight of BAS 00744654?
The molecular weight of BAS 00744654 is 322.13 g/mol.
Where can I buy BAS 00744654?
You can request a quote for BAS 00744654 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00744654?
Yes, KEHONG BIO provides custom synthesis services for BAS 00744654 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.