UPCMLD0ENAT5761988:001
TL;DR: UPCMLD0ENAT5761988:001 (CAS 433307-94-9) is a chemical compound with molecular formula C30H34N4OS and molecular weight 498.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
Also Known As: UPCMLD0ENAT5761988:001, AF-399/41048194, 4-{4-[2-(diphenylmethoxy)ethyl]piperazin-1-yl}-6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine, 1-(diphenylmethoxy)-2-[4-(6-methyl(5,6,7,8-tetrahydrobenzo[b]thiopheno[3,2-e]p yrimidin-4-yl))piperazinyl]ethane, 4-(4-(2-(benzhydryloxy)ethyl)piperazin-1-yl)-6-methyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine
| Molecular Formula | C30H34N4OS |
|---|---|
| Molecular Weight | 498.25 g/mol |
| LogP | 5.7443 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.24533 |
| Heavy Atoms | 36 |
| Complexity | 1245.0651 |
Chemical Identifiers
| CAS Number | 433307-94-9 |
|---|---|
| SMILES | CC1CCC2=C(C1)C3=C(N=CN=C3S2)N4CCN(CC4)CCOC(C5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
UPCMLD0ENAT5761988:001 (CAS 433307-94-9), with molecular formula C30H34N4OS and molecular weight 498.25 g/mol. IUPAC: 4-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine.
Chemical Property Profile of UPCMLD0ENAT5761988:001
Property Insights of UPCMLD0ENAT5761988:001
The XLogP value of 5.7443 indicates that UPCMLD0ENAT5761988:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.49 Ų, UPCMLD0ENAT5761988:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5761988:001 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5761988:001?
The CAS number of UPCMLD0ENAT5761988:001 is 433307-94-9.
What is the molecular formula of UPCMLD0ENAT5761988:001?
The molecular formula of UPCMLD0ENAT5761988:001 is C30H34N4OS.
What is the molecular weight of UPCMLD0ENAT5761988:001?
The molecular weight of UPCMLD0ENAT5761988:001 is 498.25 g/mol.
Where can I buy UPCMLD0ENAT5761988:001?
You can request a quote for UPCMLD0ENAT5761988:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5761988:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5761988:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.