![7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene structure](/static/products/899/899397-87-6.png)
7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene
TL;DR: 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene (CAS 899397-87-6) is a chemical compound with molecular formula C16H16ClN3O and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-chloro-7-(2-methylpropyl)-10-oxa-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene
Also Known As: 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene, 7-chloro-4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine, 7-chloro-4-isobutyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
| Molecular Formula | C16H16ClN3O |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 4.1116 |
| Topological Polar Surface Area | 51.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.09818 |
| Heavy Atoms | 21 |
| Complexity | 853.71124 |
Chemical Identifiers
| CAS Number | 899397-87-6 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C1CCC3)C4=C(O2)C(=NC=N4)Cl |
Product Overview
7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene (CAS 899397-87-6), with molecular formula C16H16ClN3O and molecular weight 301.10 g/mol. IUPAC: 12-chloro-7-(2-methylpropyl)-10-oxa-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene.
Chemical Property Profile of 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene
Property Insights of 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene
The XLogP value of 4.1116 indicates that 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.81 Ų, 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene has 0 hydrogen bond donor(s) and 4 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 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene?
The CAS number of 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene is 899397-87-6.
What is the molecular formula of 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene?
The molecular formula of 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene is C16H16ClN3O.
What is the molecular weight of 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene?
The molecular weight of 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene is 301.10 g/mol.
Where can I buy 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene?
You can request a quote for 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-4-isobutyl-2,3-dihydro-1H-6-oxa-5,8,10-triaza-cyclopenta[c]fluorene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.