KT 90
TL;DR: KT 90 (CAS 129200-07-3) is a chemical compound with molecular formula C24H27NO4S and molecular weight 425.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4R,4aR,7R,7aR,12bS)-7-acetylsulfanyl-3-(cyclopropylmethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] acetate
Also Known As: KT 90, (5alpha,6beta)-6-(Acetylthio)-17-(cyclopropylmethyl)-7,8-didehydro-4,5-epoxymorphinan-3-ol acetate (ester), Morphinan-3-ol, 6-(acetylthio)-17-(cyclopropylmethyl)-7,8-didehydro-4,5-epoxy-, acetate (ester), (5alpha,6beta)-, 6-(Acetylsulfanyl)-17-(cyclopropylmethyl)-7,8-didehydro-4,5-epoxymorphinan-3-yl acetate, (-)-3-(Acetyloxy)-6beta-(acetylthio)-17-[(cyclopropyl)methyl]-7,8-didehydro-4,5alpha-epoxymorphinan
| Molecular Formula | C24H27NO4S |
|---|---|
| Molecular Weight | 425.17 g/mol |
| LogP | 3.4854 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 425.16608 |
| Heavy Atoms | 30 |
| Complexity | 970.19775 |
Chemical Identifiers
| CAS Number | 129200-07-3 |
|---|---|
| SMILES | CC(=O)OC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4CC6CC6)[C@@H](O2)[C@@H](C=C5)SC(=O)C)C=C1 |
Product Overview
KT 90 (CAS 129200-07-3), with molecular formula C24H27NO4S and molecular weight 425.17 g/mol. IUPAC: [(4R,4aR,7R,7aR,12bS)-7-acetylsulfanyl-3-(cyclopropylmethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] acetate.
Chemical Property Profile of KT 90
Property Insights of KT 90
The XLogP value of 3.4854 indicates that KT 90 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, KT 90 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KT 90 has 0 hydrogen bond donor(s) and 6 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 KT 90?
The CAS number of KT 90 is 129200-07-3.
What is the molecular formula of KT 90?
The molecular formula of KT 90 is C24H27NO4S.
What is the molecular weight of KT 90?
The molecular weight of KT 90 is 425.17 g/mol.
Where can I buy KT 90?
You can request a quote for KT 90 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KT 90?
Yes, KEHONG BIO provides custom synthesis services for KT 90 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.