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CAS 1780863-90-2 7-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol molecular structure lightbox
CAS RN: 1780863-90-2

7-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol

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Available package options are listed below.

1 package records0 with current stock
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250728 200mg Out of stock 5-7 business days Inquiry
  • Product code: LINM927272
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1780863-90-2 / 7-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol

Standard CAS: 1780863-90-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1780863-90-2
Multi CAS
No
Molecular Formula
C11H14O2
Molecular Weight
178.230000
Exact Mass
178.099380
SMILES
COC1CCC2=C(C1)C(=CC=C2)O
InChI
InChI=1S/C11H14O2/c1-13-9-6-5-8-3-2-4-11(12)10(8)7-9/h2-4,9,12H,5-7H2,1H3
InChIKey
WGOAOEHQYVRROT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
50.93
TPSA
29.46

LogP / Solubility

WLOGP
1.9
MLOGP
1.67
XLogP3
2.1
Consensus LogP
1.89
Log S (ESOL)
-2.41
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.51
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.46

Drug-likeness / Medicinal Chemistry

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

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