![CAS 324763-46-4 (3S,5S)-5-(1S,3S)-1-Azido-3-[4-methoxy-3-(3-methoxypropoxy)benzy l]-4-methylpentyl-3-isopropyldihydro-2(3H)-furanone molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/324763-46-4.png)
CAS RN: 324763-46-4
(3S,5S)-5-(1S,3S)-1-Azido-3-[4-methoxy-3-(3-methoxypropoxy)benzy l]-4-methylpentyl-3-isopropyldihydro-2(3H)-furanone
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260601 | 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: LINS857365
324763-46-4 / (3S,5S)-5-[(1S,3S)-1-azido-3-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-4-methylpentyl]-3-propan-2-yloxolan-2-one
Basic Information
CAS
324763-46-4
Multi CAS
Yes
Molecular Formula
C50H78N6O10
Molecular Weight
923.200000
Exact Mass
922.577943
InChI
InChI=1S/2C25H39N3O5/c2*1-16(2)19(14-21(27-28-26)23-15-20(17(3)4)25(29)33-23)12-18-8-9-22(31-6)24(13-18)32-11-7-10-30-5/h2*8-9,13,16-17,19-21,23H,7,10-12,14-15H2,1-6H3/t2*19-,20-,21-,23-/m00/s1
InChIKey
CZTZDAGRYZGOAC-XEYWKLMWSA-N
Computed Properties
Structural Parameters
Heavy atom count
66
Aromatic heavy atom count
12
Fraction Csp3
0.72
Rotatable bonds
28
H-bond acceptors
12
Molar refractivity
254.78
TPSA
205.5
LogP / Solubility
WLOGP
11.16
MLOGP
9.91
XLogP3
11.16
Consensus LogP
10.74
Log S (ESOL)
-10.88
Class (ESOL)
Insoluble
Log S (Ali)
-15.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-18.29
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.43
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
8.5
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