CAS RN: 99522-79-9
Pranidipine
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250927 |
10mg / 25mg / 100mg |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS99522-79-9
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Purity/Analytical Methods:
>99.0%
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99522-79-9 / 3-O-methyl 5-O-(3-phenylprop-2-enyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Standard CAS: 99522-79-9
Multi CAS: Yes
Basic Information
CAS
99522-79-9
Multi CAS
Yes
Molecular Formula
C25H24N2O6
Molecular Weight
448.500000
Exact Mass
448.163436
InChI
InChI=1S/C25H24N2O6/c1-16-21(24(28)32-3)23(19-12-7-13-20(15-19)27(30)31)22(17(2)26-16)25(29)33-14-8-11-18-9-5-4-6-10-18/h4-13,15,23,26H,14H2,1-3H3/b11-8+
InChIKey
XTFPDGZNWTZCMF-DHZHZOJOSA-N
Computed Properties
Structural Parameters
Heavy atom count
33
Aromatic heavy atom count
12
Fraction Csp3
0.2
Rotatable bonds
7
H-bond acceptors
7
H-bond donors
1
Molar refractivity
122.82
TPSA
107.77
LogP / Solubility
WLOGP
4.26
MLOGP
3.78
XLogP3
4.7
Consensus LogP
4.25
Log S (ESOL)
-5.11
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.31
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.95
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.43
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3