![(E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one structure](/static/products/259/259820-46-7.png)
(E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
TL;DR: (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one (CAS 259820-46-7) is a chemical compound with molecular formula C21H21ClN2O and molecular weight 352.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10a-[(E)-2-(2-chlorophenyl)ethenyl]-10,10-dimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one
Also Known As: (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one, 10a-[(1E)-2-(2-chlorophenyl)vinyl]-10,10-dimethyl-1H,3H,4H-1,3-diazaperhydroin o[1,2-a]indolin-2-one, 10a-[(E)-2-(2-chlorophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one, 10a-[(E)-2-(2-chlorophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2-ol, 10a-[(E)-2-(2-chlorophenyl)ethenyl]-10,10-dimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one
| Molecular Formula | C21H21ClN2O |
|---|---|
| Molecular Weight | 352.13 g/mol |
| LogP | 4.3672 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.13425 |
| Heavy Atoms | 25 |
| Complexity | 873.7047 |
Chemical Identifiers
| CAS Number | 259820-46-7 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2N3C1(NC(=O)CC3)/C=C/C4=CC=CC=C4Cl)C |
Product Overview
(E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one (CAS 259820-46-7), with molecular formula C21H21ClN2O and molecular weight 352.13 g/mol. IUPAC: 10a-[(E)-2-(2-chlorophenyl)ethenyl]-10,10-dimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one.
Chemical Property Profile of (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Property Insights of (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
The XLogP value of 4.3672 indicates that (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one has 1 hydrogen bond donor(s) and 2 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 (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one?
The CAS number of (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one is 259820-46-7.
What is the molecular formula of (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one?
The molecular formula of (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one is C21H21ClN2O.
What is the molecular weight of (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one?
The molecular weight of (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one is 352.13 g/mol.
Where can I buy (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one?
You can request a quote for (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-10a-(2-chlorostyryl)-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.