CAS RN: 170082-17-4

2’H-Androst-2-eno[3,2-c]pyrazol-5′(1’H)-one, 17-hydroxy-17-(methyl-d3)-, (5α,17β)- (9CI)

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Batchno.20251210 1mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS170082-17-4
  • Purity/Analytical Methods: >99.0%
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170082-17-4 / (1S,2S,10S,13R,14S,17S,18S)-17-hydroxy-2,18-dimethyl-17-(trideuteriomethyl)-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icos-4(8)-en-5-one

3'-Hydroxy Stanozolol-d3 | 3'-Hydroxy Stanozolol-d3 (1.0mg/ml in Methanol) | 3a(2)-Hydroxystanozolol-d3

Standard CAS: 170082-17-4 Multi CAS: Yes

Basic Information

CAS
170082-17-4
Multi CAS
Yes
Molecular Formula
C21H32N2O2
Molecular Weight
347.500000
Exact Mass
347.265209
SMILES
[2H]C([2H])([2H])[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC5=C(C4)NNC5=O)C)C)O
InChI
InChI=1S/CH4O/c1-2/h2H,1H3
InChIKey
OKKJLVBELUTLKV-UHFFFAOYSA-N
Synonyms
3'-Hydroxy Stanozolol-d3 3'-Hydroxy Stanozolol-d3 (1.0mg/ml in Methanol) 3a(2)-Hydroxystanozolol-d3 DTXSID201366592 3'-Hydroxy Stanozolol-d3 (1 mg/ml in Methanol)

Physical Properties

Storage Conditions
Permanently installed fire-extinguishing equipment should be provided in large storage facilities. Water cannons are generally installed in storage tank farms to cool steel constructions and neighboring tanks in the event of fire. Large tanks should have permanently installed piping systems for alcohol-resistant fire-extinguishing foams. Small-Scale Storage. Small amounts ( For more Storage Conditions (Complete) data for Methanol (6 total), please visit the HSDB record page.

Computed Properties

Structural Parameters

Heavy atom count
2
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
8.14
TPSA
20.23

LogP / Solubility

WLOGP
-0.39
MLOGP
-0.36
XLogP3
-0.5
Consensus LogP
-0.42
Log S (ESOL)
0.21
Class (ESOL)
Highly soluble
Log S (Ali)
0.46
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.46
Class (SILICOS-IT)
Highly 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)
-3.19

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Flammable Acute Toxic Health Hazard Irritant
Signal
Danger
GHS Hazard Statements
H225: Highly Flammable liquid and vapor [Danger Flammable liquids] H301: Toxic if swallowed [Danger Acute toxicity, oral] H311: Toxic in contact with skin [Danger Acute toxicity, dermal] H331: Toxic if inhaled [Danger Acute toxicity, inhalation] H370 **: Causes damage to organs [Danger Specific target organ toxicity, single exposure]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P308+P316, P316, P321, P330, P361+P364, P370+P378, P403+P233, P403+P235, P405, and P501 P203, P280, P318, P405, and P501 P203, P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P303+P361+P353, P304+P340, P305+P351+P338, P308+P316, P318, P319, P321, P330, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501 P203, P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P303+P361+P353, P304+P340, P305+P351+P338, P308+P316, P318, P319, P321, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501
DOT ID (UN/NA Number)
1230
Hazard Class/Division
3
Packing Group
II

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