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CAS 83919-23-7 Mometasone Furoate molecular structure lightbox
CAS RN: 83919-23-7

Mometasone Furoate

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4 package records4 with current stock2 grade groups
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Batchno.20250516 1g In stock Inquiry
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Batchno.20250831 1ml In stock Inquiry
  • Product code: ICTM2354
  • Purity/Analytical Methods: >98.0%(HPLC)
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83919-23-7 / [9-chloro-17-(2-chloroacetyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] furan-2-carboxylate

Standard CAS: 83919-23-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
83919-23-7
Multi CAS
Yes
Molecular Formula
C27H30CL2O6
Molecular Weight
521.400000
Exact Mass
520.141944
InChI
InChI=1S/C27H30Cl2O6/c1-15-11-19-18-7-6-16-12-17(30)8-9-24(16,2)26(18,29)21(31)13-25(19,3)27(15,22(32)14-28)35-23(33)20-5-4-10-34-20/h4-5,8-10,12,15,18-19,21,31H,6-7,11,13-14H2,1-3H3
InChIKey
WOFMFGQZHJDGCX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
35
Aromatic heavy atom count
5
Fraction Csp3
0.59
Rotatable bonds
4
H-bond acceptors
6
H-bond donors
1
Molar refractivity
130.23
TPSA
93.81

LogP / Solubility

WLOGP
4.87
MLOGP
4.32
XLogP3
3.9
Consensus LogP
4.36
Log S (ESOL)
-5.98
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.35
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.57
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.44

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7.5

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