![5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one structure](/static/products/844/844654-47-3.png)
5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one
TL;DR: 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one (CAS 844654-47-3) is a chemical compound with molecular formula C24H29N3O5 and molecular weight 439.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-6-one
Also Known As: 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one, 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-5,7,8,9-tetrahydro-3H-chromeno[2,3-d]pyrimidin-6(4H)-one, 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-6-one
| Molecular Formula | C24H29N3O5 |
|---|---|
| Molecular Weight | 439.21 g/mol |
| LogP | 2.92967 |
| Topological Polar Surface Area | 106.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.21072 |
| Heavy Atoms | 32 |
| Complexity | 1148.8091 |
Chemical Identifiers
| CAS Number | 844654-47-3 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)N=CN(C3=N)CCCO)C4=CC(=C(C=C4)OC)OC)C(=O)C1)C |
Product Overview
5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one (CAS 844654-47-3), with molecular formula C24H29N3O5 and molecular weight 439.21 g/mol. IUPAC: 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-6-one.
Chemical Property Profile of 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one
Property Insights of 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one
The XLogP value of 2.92967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one. The TPSA of 106.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one. Following Lipinski's Rule of Five, 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one has 2 hydrogen bond donor(s) and 7 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-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one?
The CAS number of 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one is 844654-47-3.
What is the molecular formula of 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one?
The molecular formula of 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one is C24H29N3O5.
What is the molecular weight of 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one?
The molecular weight of 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one is 439.21 g/mol.
Where can I buy 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one?
You can request a quote for 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,4-dimethoxyphenyl)-3-(3-hydroxypropyl)-4-imino-8,8-dimethyl-3,4,5,7,8,9-hexahydro-6H-chromeno[2,3-d]pyrimidin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.