N-{2-[4-(4,5-Dihydro-1H-imidazol-2-yl)phenyl]ethyl}-5-({[(4-methoxy-2,6-dimethylphenyl)sulfonyl](methyl)amino}methyl)-N-methyl-1,3,4-thiadiazole-2-carboxamide

HCID 46175210
노트반응
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
COc1cc(C)c(S(=O)(=O)N(C)Cc2nnc(C(=O)N(C)CCc3ccc(C4=NCCN4)cc3)s2)c(C)c1
InChIKey
HCTGNOGDYVCAAY-UHFFFAOYSA-N
분자식
C26H32N6O4S2
평균 분자량
556.7 g/mol

이름 및 식별자

우선 이름
N-{2-[4-(4,5-Dihydro-1H-imidazol-2-yl)phenyl]ethyl}-5-({[(4-methoxy-2,6-dimethylphenyl)sulfonyl](methyl)amino}methyl)-N-methyl-1,3,4-thiadiazole-2-carboxamide
IUPAC
N-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]ethyl]-5-[[(4-methoxy-2,6-dimethylphenyl)sulfonyl-methylamino]methyl]-N-methyl-1,3,4-thiadiazole-2-carboxamide

이름 및 동의어

SCHEMBL2238241HCTGNOGDYVCAAY-UHFFFAOYSA-NN-{2-[4-(4,5-Dihydro-1H-imidazol-2-yl)phenyl]ethyl}-5-({[(4-methoxy-2,6-dimethylphenyl)sulfonyl](methyl)amino}methyl)-N-methyl-1,3,4-thiadiazole-2-carboxamide

데이터베이스 식별자

PubChem CID
46175210

물성

구조 계산 물성

XLogP
2.5
극성 표면적
154 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
9
회전 가능 결합 수
10
무거운 원자 수
38

관련 반응

1건
반응 기록 만들기

화합물 노트

불러오는 중…