CAS RN: 1509929-20-7

Pyridine, 2-[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]-6-phenyl-

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251220 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
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Batchno.20250405 100mg In stock Shanghai Inquiry
Batchno.20251121 1g In stock Shanghai Inquiry
Batchno.20260428 250mg In stock Shanghai Inquiry
  • Product code: starshine_CAS1509929-20-7
  • Purity/Analytical Methods: >99.0%
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1509929-20-7 / (4S)-2-(6-phenyl-2-pyridinyl)-4-propan-2-yl-4,5-dihydro-1,3-oxazole

Standard CAS: 1509929-20-7 Multi CAS: No

Basic Information

CAS
1509929-20-7
Multi CAS
No
Molecular Formula
C17H18N2O
Molecular Weight
266.340000
Exact Mass
266.141913
SMILES
CC(C)[C@H]1COC(=N1)C2=CC=CC(=N2)C3=CC=CC=C3
InChI
InChI=1S/C17H18N2O/c1-12(2)16-11-20-17(19-16)15-10-6-9-14(18-15)13-7-4-3-5-8-13/h3-10,12,16H,11H2,1-2H3/t16-/m1/s1
InChIKey
UCJZWXYRFWPQSW-MRXNPFEDSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.29
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
80.79
TPSA
34.48

LogP / Solubility

WLOGP
3.55
MLOGP
3.13
XLogP3
3.7
Consensus LogP
3.46
Log S (ESOL)
-3.97
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.7
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.82

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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