CS-1004903
(6α,11β,16α,17α)-2-Chloro-6,9-difluoro-11,17-dihydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic acid
Manufacturer: ChemScene
CAS Number: 80157-55-7
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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
C₂₁H₂₅ClF₂O₅
Molecular Weight
430.87
Synonyms
None
SMILES
F[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)[C@](C(O)=O)(O)[C@H](C)C3)[H])(C[C@H](F)C=4[C@]2(C)C=C(Cl)C(=O)C4)[H]
Tpsa
94.83
Logp
2.9334
H Acceptors
4
H Donors
3
Rotatable Bonds
1
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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: C₂₁H₂₅ClF₂O₅
Molecular Weight: 430.87
Synonyms: None
SMILES: F[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)[C@](C(O)=O)(O)[C@H](C)C3)[H])(C[C@H](F)C=4[C@]2(C)C=C(Cl)C(=O)C4)[H]
Tpsa: 94.83
Logp: 2.9334
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₅ClF₂O₅
Molecular Weight:
430.87
Synonyms:
None
SMILES:
F[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)[C@](C(O)=O)(O)[C@H](C)C3)[H])(C[C@H](F)C=4[C@]2(C)C=C(Cl)C(=O)C4)[H]
Tpsa:
94.83
Logp:
2.9334
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₉N₅O₄
Molecular Weight: 427.50
Synonyms: None
SMILES: O=C1C=2C=CC=C(N)C2C(=O)C=3C(=CC=C(NCCNCCO)C13)NCCNCCO
Tpsa: 148.74
Logp: 0.0318
H Acceptors: 9
H Donors: 7
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₉N₅O₄
Molecular Weight:
427.50
Synonyms:
None
SMILES:
O=C1C=2C=CC=C(N)C2C(=O)C=3C(=CC=C(NCCNCCO)C13)NCCNCCO
Tpsa:
148.74
Logp:
0.0318
H Acceptors:
9
H Donors:
7
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇NO₃
Molecular Weight: 223.27
Synonyms: None
SMILES: OCC1=CN=C(C=2OC(OCC21)C(C)C)C
Tpsa: 51.58
Logp: 1.77342
H Acceptors: 4
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:
C₁₂H₁₇NO₃
Molecular Weight:
223.27
Synonyms:
None
SMILES:
OCC1=CN=C(C=2OC(OCC21)C(C)C)C
Tpsa:
51.58
Logp:
1.77342
H Acceptors:
4
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: C₁₃H₁₂O₇
Molecular Weight: 280.23
Synonyms: None
SMILES: O=C(O)C=1OC2=CC=CC(OCC(O)CO)=C2C(=O)C1
Tpsa: 117.2
Logp: 0.2232
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂O₇
Molecular Weight:
280.23
Synonyms:
None
SMILES:
O=C(O)C=1OC2=CC=CC(OCC(O)CO)=C2C(=O)C1
Tpsa:
117.2
Logp:
0.2232
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
5