CS-1001990
4-[[6-Amino-5-bromo-2-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethylbenzamide
Manufacturer: ChemScene
CAS Number: 1706943-59-0
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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
C₂₀H₁₇BrN₆O₂
Molecular Weight
453.29
Synonyms
None
SMILES
N#CC1=CC=C(C=C1)NC=2N=C(OC=3C(=CC(=CC3C)C(=O)N)C)C(Br)=C(N2)N
Tpsa
139.94
Logp
3.94462
H Acceptors
7
H Donors
3
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1706943-59-0 | Descyano Etravirine Formamide | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.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: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₇BrN₆O₂
Molecular Weight: 453.29
Synonyms: None
SMILES: N#CC1=CC=C(C=C1)NC=2N=C(OC=3C(=CC(=CC3C)C(=O)N)C)C(Br)=C(N2)N
Tpsa: 139.94
Logp: 3.94462
H Acceptors: 7
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:
C₂₀H₁₇BrN₆O₂
Molecular Weight:
453.29
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1)NC=2N=C(OC=3C(=CC(=CC3C)C(=O)N)C)C(Br)=C(N2)N
Tpsa:
139.94
Logp:
3.94462
H Acceptors:
7
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: C₂₀H₂₃ClN₂
Molecular Weight: 326.86
Synonyms: None
SMILES: ClC1=CC=C2C(=C1)CCC3=CC=CN=C3C2C4CCN(C)CC4
Tpsa: 16.13
Logp: 4.3073
H Acceptors: 2
H Donors: 0
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:
C₂₀H₂₃ClN₂
Molecular Weight:
326.86
Synonyms:
None
SMILES:
ClC1=CC=C2C(=C1)CCC3=CC=CN=C3C2C4CCN(C)CC4
Tpsa:
16.13
Logp:
4.3073
H Acceptors:
2
H Donors:
0
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: C₂₀H₁₉F₆NO₂
Molecular Weight: 419.36
Synonyms: None
SMILES: O([C@@H](C)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)[C@@H]2[C@@H](NCCO2)C3=CC=CC=C3
Tpsa: 30.49
Logp: 5.489
H Acceptors: 3
H Donors: 1
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:
C₂₀H₁₉F₆NO₂
Molecular Weight:
419.36
Synonyms:
None
SMILES:
O([C@@H](C)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)[C@@H]2[C@@H](NCCO2)C3=CC=CC=C3
Tpsa:
30.49
Logp:
5.489
H Acceptors:
3
H Donors:
1
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: C₁₈H₂₁NO₂
Molecular Weight: 283.36
Synonyms: None
SMILES: O=C(NC=1C=CC=CC1CC=2C=CC=CC2)COC(C)C
Tpsa: 38.33
Logp: 3.6409
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₁NO₂
Molecular Weight:
283.36
Synonyms:
None
SMILES:
O=C(NC=1C=CC=CC1CC=2C=CC=CC2)COC(C)C
Tpsa:
38.33
Logp:
3.6409
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
6