![N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide structure](/static/products/384/384374-40-7.png)
N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide
TL;DR: N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide (CAS 384374-40-7) is a chemical compound with molecular formula C29H31N3O3S2 and molecular weight 533.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[[4-(4-methylphenyl)-3-oxo-12-propan-2-yl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]propanamide
Also Known As: N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide, N-benzyl-2-{[3-(4-methylphenyl)-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanamide
| Molecular Formula | C29H31N3O3S2 |
|---|---|
| Molecular Weight | 533.18 g/mol |
| LogP | 5.64992 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 533.18066 |
| Heavy Atoms | 37 |
| Complexity | 1476.5569 |
Chemical Identifiers
| CAS Number | 384374-40-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC(C)C(=O)NCC4=CC=CC=C4)SC5=C3CC(OC5)C(C)C |
Product Overview
N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide (CAS 384374-40-7), with molecular formula C29H31N3O3S2 and molecular weight 533.18 g/mol. IUPAC: N-benzyl-2-[[4-(4-methylphenyl)-3-oxo-12-propan-2-yl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]propanamide.
Chemical Property Profile of N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide
Property Insights of N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide
The XLogP value of 5.64992 indicates that N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide. Following Lipinski's Rule of Five, N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide has 1 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 N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide?
The CAS number of N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide is 384374-40-7.
What is the molecular formula of N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide?
The molecular formula of N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide is C29H31N3O3S2.
What is the molecular weight of N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide?
The molecular weight of N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide is 533.18 g/mol.
Where can I buy N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide?
You can request a quote for N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2-((6-isopropyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.