CS-0531734
(1S,8R,9S,10S,13S,14S,17R)-17-Acetyl-6-chloro-1-(chloromethyl)-10,13-dimethyl-3-oxo-2,3,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl acetate Cyproterone Acetate Impurity
Manufacturer: ChemScene
CAS Number: 17183-98-1
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Purity
98%
MDL No
MFCD09833378
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₄H₃₀Cl₂O₄
Molecular Weight
453.40
Synonyms
6-chloro-1α-chloromethyl-3,20-dioxo-pregna-4,6-dien-17α-acetoxy
SMILES
CC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@@]4(C(C(Cl)=C3)=CC(C[C@@H]4CCl)=O)C)([H])CC2)([H])CC1)C)C(C)=O)=O
Tpsa
60.44
Logp
5.2166
H Acceptors
4
H Donors
0
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 17183-98-1 | Pregna-4,6-diene-3,20-dione,17-(acetyloxy)-6-chloro-1-(chloromethyl)-, (1a)- | A2B Chem | ₹ 11,122.80 - ₹ 23,357.88 |
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https://dev-s3.chemscene.com/web-image/physicalization/health-hazard.svg
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: MFCD09833378
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₀Cl₂O₄
Molecular Weight: 453.40
Synonyms: 6-chloro-1α-chloromethyl-3,20-dioxo-pregna-4,6-dien-17α-acetoxy
SMILES: CC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@@]4(C(C(Cl)=C3)=CC(C[C@@H]4CCl)=O)C)([H])CC2)([H])CC1)C)C(C)=O)=O
Tpsa: 60.44
Logp: 5.2166
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD09833378
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₀Cl₂O₄
Molecular Weight:
453.40
Synonyms:
6-chloro-1α-chloromethyl-3,20-dioxo-pregna-4,6-dien-17α-acetoxy
SMILES:
CC(O[C@]1([C@@]2([C@@]([C@@]3([H])[C@]([C@@]4(C(C(Cl)=C3)=CC(C[C@@H]4CCl)=O)C)([H])CC2)([H])CC1)C)C(C)=O)=O
Tpsa:
60.44
Logp:
5.2166
H Acceptors:
4
H Donors:
0
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: C₂₅H₃₃ClO₆
Molecular Weight: 464.98
Synonyms: Beclomethasone 21-Monopropionate
SMILES: C[C@@]12[C@](C[C@@H]([C@]2(O)C(COC(CC)=O)=O)C)([H])[C@@]3([H])[C@]([C@H](C1)O)([C@@]4(C(CC3)=CC(C=C4)=O)C)Cl
Tpsa: 100.9
Logp: 3.1259
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₃ClO₆
Molecular Weight:
464.98
Synonyms:
Beclomethasone 21-Monopropionate
SMILES:
C[C@@]12[C@](C[C@@H]([C@]2(O)C(COC(CC)=O)=O)C)([H])[C@@]3([H])[C@]([C@H](C1)O)([C@@]4(C(CC3)=CC(C=C4)=O)C)Cl
Tpsa:
100.9
Logp:
3.1259
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₁ClO₅
Molecular Weight: 434.95
Synonyms: 6β-Chloro-7α-hydroxy-6,7-dihydro Cyproterone Acetate
SMILES: C[C@@]12[C@]3([H])[C@]([C@@H]([C@H](C1=CC([C@@]4([H])[C@]2([H])C4)=O)Cl)O)([H])[C@@]5([H])[C@](CC3)([C@@](C(C)=O)(CC5)OC(C)=O)C
Tpsa: 80.67
Logp: 3.4532
H Acceptors: 5
H Donors: 1
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:
C₂₄H₃₁ClO₅
Molecular Weight:
434.95
Synonyms:
6β-Chloro-7α-hydroxy-6,7-dihydro Cyproterone Acetate
SMILES:
C[C@@]12[C@]3([H])[C@]([C@@H]([C@H](C1=CC([C@@]4([H])[C@]2([H])C4)=O)Cl)O)([H])[C@@]5([H])[C@](CC3)([C@@](C(C)=O)(CC5)OC(C)=O)C
Tpsa:
80.67
Logp:
3.4532
H Acceptors:
5
H Donors:
1
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: C₂₀H₃₀N₈
Molecular Weight: 382.51
Synonyms: 2-[4-[4-(4-Pyrimidin-2-ylpiperazin-1-yl)butyl]piperazin-1-yl]pyrimidine
SMILES: C1(N2CCN(CCCCN3CCN(CC3)C4=NC=CC=N4)CC2)=NC=CC=N1
Tpsa: 64.52
Logp: 0.991
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₃₀N₈
Molecular Weight:
382.51
Synonyms:
2-[4-[4-(4-Pyrimidin-2-ylpiperazin-1-yl)butyl]piperazin-1-yl]pyrimidine
SMILES:
C1(N2CCN(CCCCN3CCN(CC3)C4=NC=CC=N4)CC2)=NC=CC=N1
Tpsa:
64.52
Logp:
0.991
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
7