![5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one structure](/static/products/2135/213552-75-1.webp)
5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one
TL;DR: 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one (CAS 213552-75-1) is a chemical compound with molecular formula C18H17N3OS and molecular weight 323.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzylideneamino)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 3-(benzylideneamino)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 3-(benzylideneamino)-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C18H17N3OS |
|---|---|
| Molecular Weight | 323.11 g/mol |
| LogP | 3.52742 |
| Topological Polar Surface Area | 47.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.10922 |
| Heavy Atoms | 23 |
| Complexity | 953.7974 |
Chemical Identifiers
| CAS Number | 213552-75-1 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1N=CC4=CC=CC=C4 |
Product Overview
5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one (CAS 213552-75-1), with molecular formula C18H17N3OS and molecular weight 323.11 g/mol. IUPAC: 3-(benzylideneamino)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Property Insights of 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one
The XLogP value of 3.52742 indicates that 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.25 Ų, 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one has 0 hydrogen bond donor(s) and 4 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 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one?
The CAS number of 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one is 213552-75-1.
What is the molecular formula of 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one?
The molecular formula of 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one is C18H17N3OS.
What is the molecular weight of 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one?
The molecular weight of 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one is 323.11 g/mol.
Where can I buy 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one?
You can request a quote for 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7,8-Tetrahydro-2-methyl-3-[(phenylmethylene)amino][1]benzothieno[2,3-d]pyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.