BAS 03754536
TL;DR: BAS 03754536 (CAS 442571-06-4) is a chemical compound with molecular formula C17H26N4S and molecular weight 318.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N',N'-diethyl-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)propane-1,3-diamine
Also Known As: BAS 03754536, AP-906/41027464, N,N-diethyl-N'-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)propane-1,3-diamine, N',N'-diethyl-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)propane-1,3-diamine, diethyl[3-(5,6,7,8-tetrahydrobenzo[b]thiopheno[3,2-e]pyrimidin-4-ylamino)propy l]amine
| Molecular Formula | C17H26N4S |
|---|---|
| Molecular Weight | 318.19 g/mol |
| LogP | 3.7139 |
| Topological Polar Surface Area | 41.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 318.1878 |
| Heavy Atoms | 22 |
| Complexity | 618.3916 |
Chemical Identifiers
| CAS Number | 442571-06-4 |
|---|---|
| SMILES | CCN(CC)CCCNC1=C2C3=C(CCCC3)SC2=NC=N1 |
Product Overview
BAS 03754536 (CAS 442571-06-4), with molecular formula C17H26N4S and molecular weight 318.19 g/mol. IUPAC: N',N'-diethyl-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)propane-1,3-diamine.
Chemical Property Profile of BAS 03754536
Property Insights of BAS 03754536
The XLogP value of 3.7139 indicates that BAS 03754536 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.05 Ų, BAS 03754536 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 03754536 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 03754536?
The CAS number of BAS 03754536 is 442571-06-4.
What is the molecular formula of BAS 03754536?
The molecular formula of BAS 03754536 is C17H26N4S.
What is the molecular weight of BAS 03754536?
The molecular weight of BAS 03754536 is 318.19 g/mol.
Where can I buy BAS 03754536?
You can request a quote for BAS 03754536 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03754536?
Yes, KEHONG BIO provides custom synthesis services for BAS 03754536 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.