IDI1_023781
TL;DR: IDI1_023781 (CAS 159582-37-3) is a chemical compound with molecular formula C18H18N4O2 and molecular weight 322.14297 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-13,13-dimethyl-8-phenyl-12-oxa-4,6,8-triazatricyclo[8.4.0.02,7]tetradeca-1(10),2,4,6-tetraen-9-one
Also Known As: IDI1_023781, BRD-K19029069-001-01-9, 1-imino-9,9-dimethyl-5-phenyl-5,7,9,10-tetrahydro-1H-pyrano[4',3':4,5]pyrido[2,3-d]pyrimidin-6(2H)-one, 1-imino-9,9-dimethyl-5-phenyl-1,2,5,7,9,10-hexahydro-6H-pyrano[4',3':4,5]pyrido[2,3-d]pyrimidin-6-one
Technical Specifications
| Molecular Formula | C18H18N4O2 |
| Molecular Weight | 322.14297 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 81.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 322.14297 Da |
| Heavy Atoms | 24 |
| Complexity | 553.0 |
| SMILES | CC1(CC2=C(CO1)C(=O)N(C3=NC=NC(=C23)N)C4=CC=CC=C4)C |
| InChIKey | KZICYUDNJKDUAX-UHFFFAOYSA-N |
Chemical Property Profile of IDI1_023781
Property Insights of IDI1_023781
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IDI1_023781. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for IDI1_023781. Following Lipinski's Rule of Five, IDI1_023781 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of IDI1_023781?
The CAS number of IDI1_023781 is 159582-37-3.
What is the molecular formula of IDI1_023781?
The molecular formula of IDI1_023781 is C18H18N4O2.
What is the molecular weight of IDI1_023781?
The molecular weight of IDI1_023781 is 322.14297 g/mol.
Where can I buy IDI1_023781?
You can request a quote for IDI1_023781 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for IDI1_023781?
Yes, CoreyChem provides custom synthesis services for IDI1_023781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.