![9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one structure](/static/products/877/877623-16-0.webp)
9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
TL;DR: 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one (CAS 877623-16-0) is a chemical compound with molecular formula C16H18ClN3O2 and molecular weight 319.10876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-chloro-3-(3-propan-2-yloxypropyl)-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 9-chloro-3-(3-isopropoxypropyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 9-chloro-3-(3-propan-2-yloxypropyl)-5H-pyrimido[5,4-b]indol-4-one, 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Technical Specifications
| Molecular Formula | C16H18ClN3O2 |
| Molecular Weight | 319.10876 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 57.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.10876 Da |
| Heavy Atoms | 22 |
| Complexity | 443.0 |
| SMILES | CC(C)OCCCN1C=NC2=C(C1=O)NC3=C2C(=CC=C3)Cl |
| InChIKey | IZMBUJCPMLJLON-UHFFFAOYSA-N |
Chemical Property Profile of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Property Insights of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
The XLogP value of 3.0 indicates that 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The CAS number of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 877623-16-0.
What is the molecular formula of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular formula of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is C16H18ClN3O2.
What is the molecular weight of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
The molecular weight of 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one is 319.10876 g/mol.
Where can I buy 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
You can request a quote for 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one?
Yes, CoreyChem provides custom synthesis services for 9-chloro-3-[3-(propan-2-yloxy)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.