CS-1000642
Androstane-3,17-diol, 2,16-di-1-piperidinyl-, 3-acetate, (2β,3α,5α,16β,17α)-
Manufacturer: ChemScene
CAS Number: 119302-68-0
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₁H₅₂N₂O₃
Molecular Weight
500.76
Synonyms
None
SMILES
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC[C@]1(C[C@H](OC(C)=O)[C@H](C2)N6CCCCC6)[H])[H])[H]
Tpsa
53.01
Logp
5.2505
H Acceptors
5
H Donors
1
Rotatable Bonds
3
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₅₂N₂O₃
Molecular Weight: 500.76
Synonyms: None
SMILES: C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC[C@]1(C[C@H](OC(C)=O)[C@H](C2)N6CCCCC6)[H])[H])[H]
Tpsa: 53.01
Logp: 5.2505
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₅₂N₂O₃
Molecular Weight:
500.76
Synonyms:
None
SMILES:
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC[C@]1(C[C@H](OC(C)=O)[C@H](C2)N6CCCCC6)[H])[H])[H]
Tpsa:
53.01
Logp:
5.2505
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₅₂N₂O₃
Molecular Weight: 500.76
Synonyms: None
SMILES: C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@@](CC3)(C[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC1)[H])[H])(C[C@@H]([C@H]2OC(C)=O)N6CCCCC6)[H]
Tpsa: 53.01
Logp: 5.2505
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₅₂N₂O₃
Molecular Weight:
500.76
Synonyms:
None
SMILES:
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@@](CC3)(C[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC1)[H])[H])(C[C@@H]([C@H]2OC(C)=O)N6CCCCC6)[H]
Tpsa:
53.01
Logp:
5.2505
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₉N₃O₅S
Molecular Weight: 317.36
Synonyms: None
SMILES: [C@H]([C@@H](C)O)(C(O)=O)[C@@]1(CC(SCCNC=N)C(=N)C(=O)O1)[H]
Tpsa: 143.56
Logp: -0.29826
H Acceptors: 7
H Donors: 5
Rotatable Bonds: 8
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₉N₃O₅S
Molecular Weight:
317.36
Synonyms:
None
SMILES:
[C@H]([C@@H](C)O)(C(O)=O)[C@@]1(CC(SCCNC=N)C(=N)C(=O)O1)[H]
Tpsa:
143.56
Logp:
-0.29826
H Acceptors:
7
H Donors:
5
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₉H₅₀N₂O₂
Molecular Weight: 458.72
Synonyms: None
SMILES: C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@@](CC3)(C[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC1)[H])[H])(C[C@@H]([C@H]2O)N6CCCCC6)[H]
Tpsa: 46.94
Logp: 4.6797
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₅₀N₂O₂
Molecular Weight:
458.72
Synonyms:
None
SMILES:
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@@](CC3)(C[C@H](O)[C@H](C4)N5CCCCC5)[H])(CC1)[H])[H])(C[C@@H]([C@H]2O)N6CCCCC6)[H]
Tpsa:
46.94
Logp:
4.6797
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2